Indoles

Description:

Compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Indoles and derivatives ⮕ Indoles

Pindolol
- ≥98%
Cas Number: 13523-86-9 Compound CID: 4828

Formula: C₁₄H₂₀N₂O₂ Molecular Weight: 248.32

IUPAC Name: 1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-ol

SMILES: CC(C)NCC(COC1=CC=CC2=C1C=CN2)O

InChIKey: JZQKKSLKJUAGIC-UHFFFAOYSA-N

InChI: InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3

Synonyms: 1-(1H-Indol-4-yloxy)-3-(isopropylamino)-2-propanol
Details

Pricing Close
5-(Benzyloxy)indole
- ≥95%
Cas Number: 1215-59-4

Formula: C₁₅H₁₃NO Molecular Weight: 223.27

IUPAC Name: 5-phenylmethoxy-1H-indole

SMILES: C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3

InChIKey: JCQLPDZCNSVBMS-UHFFFAOYSA-N

InChI: InChI=1S/C15H13NO/c1-2-4-12(5-3-1)11-17-14-6-7-15-13(10-14)8-9-16-15/h1-10,16H,11H2
Details

Pricing Close
N-(2-(1H-Indol-3-yl)ethyl)-2,2,2-trifluoroacetamide
- ≥90%
Cas Number: 319-76-6 Compound CID: 384618

Formula: C₁₂H₁₁F₃N₂O Molecular Weight: 256.23

IUPAC Name: 2,2,2-trifluoro-N-[2-(1H-indol-3-yl)ethyl]acetamide

SMILES: C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C(F)(F)F

InChIKey: KDFCROJYVJQVQK-UHFFFAOYSA-N

InChI: InChI=1S/C12H11F3N2O/c13-12(14,15)11(18)16-6-5-8-7-17-10-4-2-1-3-9(8)10/h1-4,7,17H,5-6H2,(H,16,18)
Details

Pricing Close
Methyl 4-(1H-indol-2-yl)benzoate
- ≥95%
Cas Number: 485321-10-6 Compound CID: 11470727

Formula: C₁₆H₁₃NO₂ Molecular Weight: 251.28

IUPAC Name: methyl 4-(1H-indol-2-yl)benzoate

SMILES: COC(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2

InChIKey: LXPCCNBTEKIKLX-UHFFFAOYSA-N

InChI: InChI=1S/C16H13NO2/c1-19-16(18)12-8-6-11(7-9-12)15-10-13-4-2-3-5-14(13)17-15/h2-10,17H,1H3
Details

Pricing Close
6-Fluoro-2-phenyl-1H-indole
- ≥95%
Cas Number: 255724-72-2 Compound CID: 10680001

Formula: C₁₄H₁₀FN Molecular Weight: 211.23

IUPAC Name: 6-fluoro-2-phenyl-1H-indole

SMILES: C1=CC=C(C=C1)C2=CC3=C(N2)C=C(C=C3)F

InChIKey: CIZSAUXURXLDMM-UHFFFAOYSA-N

InChI: InChI=1S/C14H10FN/c15-12-7-6-11-8-13(16-14(11)9-12)10-4-2-1-3-5-10/h1-9,16H
Details

Pricing Close
4-Fluoro-3-(piperidin-4-yl)-1H-indole
- ≥95%
Cas Number: 173150-61-3 Compound CID: 15337634

Formula: C₁₃H₁₅FN₂ Molecular Weight: 218.275

IUPAC Name: 4-fluoro-3-piperidin-4-yl-1H-indole

SMILES: C1CNCCC1C2=CNC3=C2C(=CC=C3)F

InChIKey: DEIYMTQMNDLJHX-UHFFFAOYSA-N

InChI: InChI=1S/C13H15FN2/c14-11-2-1-3-12-13(11)10(8-16-12)9-4-6-15-7-5-9/h1-3,8-9,15-16H,4-7H2
Details

Pricing Close
3-Bromo-4-nitroindole
- ≥96%
Cas Number: 126807-08-7 Compound CID: 14707933

Formula: C₈H₅BrN₂O₂ Molecular Weight: 241.05

IUPAC Name: 3-bromo-4-nitro-1H-indole

SMILES: C1=CC2=C(C(=C1)[N+](=O)[O-])C(=CN2)Br

InChIKey: VYQRPDVMVMLVHA-UHFFFAOYSA-N

InChI: InChI=1S/C8H5BrN2O2/c9-5-4-10-6-2-1-3-7(8(5)6)11(12)13/h1-4,10H
Details

Pricing Close
3-(Trifluoromethyl)-1H-indole
- ≥95%
Cas Number: 51310-55-5 Compound CID: 13152885

Formula: C₉H₆F₃N Molecular Weight: 185.15

IUPAC Name: 3-(trifluoromethyl)-1H-indole

SMILES: C1=CC=C2C(=C1)C(=CN2)C(F)(F)F

InChIKey: CLSZROKTPWVQKB-UHFFFAOYSA-N

InChI: InChI=1S/C9H6F3N/c10-9(11,12)7-5-13-8-4-2-1-3-6(7)8/h1-5,13H
Details

Pricing Close
3-(4-Hydroxybutyl)-1H-Indole-5-Carbonitrile
- ≥95%
Cas Number: 914927-40-5 Compound CID: 12150985

Formula: C₁₃H₁₄N₂O Molecular Weight: 214.26

IUPAC Name: 3-(4-hydroxybutyl)-1H-indole-5-carbonitrile

SMILES: C1=CC2=C(C=C1C#N)C(=CN2)CCCCO

InChIKey: BZXNEONCFZGWDS-UHFFFAOYSA-N

InChI: InChI=1S/C13H14N2O/c14-8-10-4-5-13-12(7-10)11(9-15-13)3-1-2-6-16/h4-5,7,9,15-16H,1-3,6H2
Details

Pricing Close
3-(4-Chloro-1-oxobutyl)indole-5-carbonitrile
- ≥98%
Cas Number: 276863-95-7 Compound CID: 10220528

Formula: C₁₃H₁₁ClN₂O Molecular Weight: 246.69

IUPAC Name: 3-(4-chlorobutanoyl)-1H-indole-5-carbonitrile

SMILES: C1=CC2=C(C=C1C#N)C(=CN2)C(=O)CCCCl

InChIKey: DFORIOBMTPKWPE-UHFFFAOYSA-N

InChI: InChI=1S/C13H11ClN2O/c14-5-1-2-13(17)11-8-16-12-4-3-9(7-15)6-10(11)12/h3-4,6,8,16H,1-2,5H2
Details

Pricing Close
3-((1H-Indol-2-yl)methyl)-1H-indole
- ≥95%
Cas Number: 114648-66-7 Compound CID: 10900930

Formula: C₁₇H₁₄N₂ Molecular Weight: 246.31

IUPAC Name: 2-(1H-indol-3-ylmethyl)-1H-indole

SMILES: C1=CC=C2C(=C1)C=C(N2)CC3=CNC4=CC=CC=C43

InChIKey: SHXKYUYEFDONQC-UHFFFAOYSA-N

InChI: InChI=1S/C17H14N2/c1-3-7-16-12(5-1)9-14(19-16)10-13-11-18-17-8-4-2-6-15(13)17/h1-9,11,18-19H,10H2
Details

Pricing Close
3-(1-Methyl-4-piperidinyl)indole
- ≥97%
Cas Number: 17403-07-5 Compound CID: 11206672

IUPAC Name: 3-(1-methylpiperidin-4-yl)-1H-indole

SMILES: CN1CCC(CC1)C2=CNC3=CC=CC=C32

InChIKey: KYSCKYJNMTUJPA-UHFFFAOYSA-N

InChI: InChI=1S/C14H18N2/c1-16-8-6-11(7-9-16)13-10-15-14-5-3-2-4-12(13)14/h2-5,10-11,15H,6-9H2,1H3
Details

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