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Pyrrolidine carboxylic acids and derivatives
Description:
Compounds containing a pyrrolidine ring which bears a carboxylic acid or a derivative thereof. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
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cis-5-Boc-1H-Hexahydropyrrolo[3，4-b]pyrroleCas Number: 180975-51-3Formula: C11H20N2O2 Molecular Weight: 212.29IUPAC Name: tert-butyl (3aS,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole-5-carboxylateSMILES: CC(C)(C)OC(=O)N1CC2CCNC2C1InChIKey: NYGXZCRPVBPJTA-DTWKUNHWSA-NInChI: InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-6-8-4-5-12-9(8)7-13/h8-9,12H,4-7H2,1-3H3/t8-,9+/m0/s1 -
Methyl 1-methylpyrrolidine-3-carboxylateCas Number: 34616-29-0 Compound CID: 13539132Formula: C7H13NO2 Molecular Weight: 143.19IUPAC Name: methyl 1-methylpyrrolidine-3-carboxylateSMILES: CN1CCC(C1)C(=O)OCInChIKey: ZWWOGQHZGYEOFM-UHFFFAOYSA-NInChI: InChI=1S/C7H13NO2/c1-8-4-3-6(5-8)7(9)10-2/h6H,3-5H2,1-2H3
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2-(iodomethyl)-1-pyrrolidinecarboxylic acid tert-butyl esterCas Number: 177750-73-1 Compound CID: 545926Formula: C10H18INO2 Molecular Weight: 311.16IUPAC Name: tert-butyl 2-(iodomethyl)pyrrolidine-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCCC1CIInChIKey: QCETXLFSWJGTAZ-UHFFFAOYSA-NInChI: InChI=1S/C10H18INO2/c1-10(2,3)14-9(13)12-6-4-5-8(12)7-11/h8H,4-7H2,1-3H3
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1-Methyl-5-oxopyrrolidine-3-carboxamideCas Number: 89677-16-7 Compound CID: 541476Formula: C6H10N2O2 Molecular Weight: 142.16IUPAC Name: 1-methyl-5-oxopyrrolidine-3-carboxamideSMILES: CN1CC(CC1=O)C(=O)NInChIKey: XDNQKOAFGDBANV-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O2/c1-8-3-4(6(7)10)2-5(8)9/h4H,2-3H2,1H3,(H2,7,10)
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(S)-tert-Butyl 3-(cyclopropylamino)pyrrolidine-1-carboxylateCas Number: 1289585-23-4 Compound CID: 53346626Formula: C12H22N2O2 Molecular Weight: 226.32IUPAC Name: tert-butyl (3R)-3-(cyclopropylamino)pyrrolidine-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCC(C1)NC2CC2InChIKey: KYEGQEQHIFRJSY-SNVBAGLBSA-NInChI: InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-7-6-10(8-14)13-9-4-5-9/h9-10,13H,4-8H2,1-3H3/t10-/m1/s1
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(R)-TERT-BUTYL 2-(CYANOMETHYL)PYRROLIDINE-1-CARBOXYLATECas Number: 201039-13-6 Compound CID: 10727173Formula: C11H18N2O2 Molecular Weight: 210.28IUPAC Name: tert-butyl (2R)-2-(cyanomethyl)pyrrolidine-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCCC1CC#NInChIKey: GSNDDHMLFYORQI-SECBINFHSA-NInChI: InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)13-8-4-5-9(13)6-7-12/h9H,4-6,8H2,1-3H3/t9-/m1/s1
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(R)-tert-Butyl 3-methoxypyrrolidine-1-carboxylateCas Number: 549532-08-3 Compound CID: 34179484Formula: C10H19NO3 Molecular Weight: 201.26IUPAC Name: tert-butyl (3R)-3-methoxypyrrolidine-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCC(C1)OCInChIKey: NGIGLOKJPWGIJT-MRVPVSSYSA-NInChI: InChI=1S/C10H19NO3/c1-10(2,3)14-9(12)11-6-5-8(7-11)13-4/h8H,5-7H2,1-4H3/t8-/m1/s1
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(R)-Tert-Butyl 2-Carbamothioylpyrrolidine-1-CarboxylateCas Number: 117175-41-4 Compound CID: 14019689IUPAC Name: tert-butyl (2R)-2-carbamothioylpyrrolidine-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCCC1C(=S)NInChIKey: KPAOKCBKJXBXNI-SSDOTTSWSA-NInChI: InChI=1S/C10H18N2O2S/c1-10(2,3)14-9(13)12-6-4-5-7(12)8(11)15/h7H,4-6H2,1-3H3,(H2,11,15)/t7-/m1/s1
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(2R，4R)-tert-Butyl 4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylate hydrochlorideCas Number: 1279038-50-4 Compound CID: 45072437Formula: C10H21ClN2O3 Molecular Weight: 252.74IUPAC Name: tert-butyl (2R,4R)-4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylate;hydrochlorideSMILES: CC(C)(C)OC(=O)N1CC(CC1CO)N.ClInChIKey: CBLODQXSQDSMHU-SCLLHFNJSA-NInChI: InChI=1S/C10H20N2O3.ClH/c1-10(2,3)15-9(14)12-5-7(11)4-8(12)6-13;/h7-8,13H,4-6,11H2,1-3H3;1H/t7-,8-;/m1./s1
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1-Benzyl-5-oxopyrrolidine-3-carboxamideCas Number: 116041-19-1 Compound CID: 5221754Formula: C12H14N2O2 Molecular Weight: 218.25IUPAC Name: 1-benzyl-5-oxopyrrolidine-3-carboxamideSMILES: C1C(CN(C1=O)CC2=CC=CC=C2)C(=O)NInChIKey: GXFFGHGZXQWFHG-UHFFFAOYSA-NInChI: InChI=1S/C12H14N2O2/c13-12(16)10-6-11(15)14(8-10)7-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,13,16)
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(S)-Tert-butyl 3-formylpyrrolidine-1-carboxylateCas Number: 191348-04-6 EC Number: 635-408-3, 635-409-9Formula: C10H17NO3 Molecular Weight: 199.25IUPAC Name: tert-butyl (3S)-3-formylpyrrolidine-1-carboxylateSMILES: CC(C)(C)OC(=O)N1CCC(C1)C=OInChIKey: DWLADVOODHZCFV-QMMMGPOBSA-NInChI: InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-5-4-8(6-11)7-12/h7-8H,4-6H2,1-3H3/t8-/m0/s1
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(R)-METHYL PYRROLIDINE-3-CARBOXYLATECas Number: 428518-43-8Formula: C6H11NO2 Molecular Weight: 129.16IUPAC Name: methyl (3R)-pyrrolidine-3-carboxylateSMILES: COC(=O)C1CCNC1InChIKey: VVWWZOKQKXPVIV-RXMQYKEDSA-NInChI: InChI=1S/C6H11NO2/c1-9-6(8)5-2-3-7-4-5/h5,7H,2-4H2,1H3/t5-/m1/s1
