N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide

C14H9N3OS — CID 60659752

IUPACN-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide
SMILESN#Cc1ccsc1NC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C14H9N3OS/c15-7-9-5-6-19-14(9)17-13(18)11-8-16-12-4-2-1-3-10(11)12/h1-6,8,16H,(H,17,18)
InChIKeyARDKSNFLPDGJSU-UHFFFAOYSA-N
MW267.31 g/mol
LogP3.35
Rot. Bonds2

About N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide

N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide (PubChem CID 60659752) has the molecular formula C14H9N3OS and a molecular weight of 267.31 g/mol. Its IUPAC name is N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide
PubChem CID60659752
Molecular FormulaC14H9N3OS
Molecular Weight267.31 g/mol
Exact Mass267.05
IUPAC NameN-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide
SMILESN#Cc1ccsc1NC(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C14H9N3OS/c15-7-9-5-6-19-14(9)17-13(18)11-8-16-12-4-2-1-3-10(11)12/h1-6,8,16H,(H,17,18)
InChIKeyARDKSNFLPDGJSU-UHFFFAOYSA-N
XLogP3.35
TPSA68.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyanothiophen-2-yl)-2-(1H-indol-3-yl)acetamide
CID 26187225
2-chloro-N-(3-cyanothiophen-2-yl)benzamide
CID 2105085
N-(3-cyanothiophen-2-yl)-2-methylbenzamide
CID 7192349
N-(3-cyano-4,5-dimethylthiophen-2-yl)-1H-indole-3-carboxamide
CID 43981400
N-(3-cyanothiophen-2-yl)-2-phenoxybenzamide
CID 7192379
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
CID 2626977
N-(3-cyanothiophen-2-yl)-2-ethylsulfonylbenzamide
CID 7578700
N-(2-hydroxyphenyl)-1H-indole-3-carboxamide
CID 57210773
N'-(3-cyanobenzoyl)-1H-indole-3-carbohydrazide
CID 30144291
N-[(4-cyanophenyl)methyl]-1H-indole-3-carboxamide
CID 60919239
N-(2-cyanopropyl)-1H-indole-3-carboxamide
CID 62651700
N-(6-chloro-2-methyl-3-pyridinyl)-1H-indole-3-carboxamide
CID 107301351

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide?
The IUPAC name of N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide (CID 60659752) is N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide.
What is the SMILES notation for N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide?
The canonical SMILES for N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide is N#Cc1ccsc1NC(=O)c1c[nH]c2ccccc12.
What is the InChIKey of N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide?
The InChIKey is ARDKSNFLPDGJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N3OS/c15-7-9-5-6-19-14(9)17-13(18)11-8-16-12-4-2-1-3-10(11)12/h1-6,8,16H,(H,17,18).
What are the key properties of N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide?
N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide has a molecular weight of 267.31 g/mol, XLogP of 3.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanothiophen-2-yl)-1H-indole-3-carboxamide is sourced from PubChem (CID 60659752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).