2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile

C14H10N4 — CID 115146342

IUPAC2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile
SMILESN#Cc1c(Nc2cccnc2)[nH]c2ccccc12
InChIInChI=1S/C14H10N4/c15-8-12-11-5-1-2-6-13(11)18-14(12)17-10-4-3-7-16-9-10/h1-7,9,17-18H
InChIKeySAHYQHCDULKVPS-UHFFFAOYSA-N
MW234.26 g/mol
LogP3.18
Rot. Bonds2

About 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile

2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile (PubChem CID 115146342) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile.

Molecular Properties

Compound Name2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile
PubChem CID115146342
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile
SMILESN#Cc1c(Nc2cccnc2)[nH]c2ccccc12
InChIInChI=1S/C14H10N4/c15-8-12-11-5-1-2-6-13(11)18-14(12)17-10-4-3-7-16-9-10/h1-7,9,17-18H
InChIKeySAHYQHCDULKVPS-UHFFFAOYSA-N
XLogP3.18
TPSA64.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(pyridin-3-ylamino)-1H-indole-3-carboxylic acid
CID 115146295
2-(thiophen-2-ylamino)-1H-indole-3-carbonitrile
CID 115146330
2-(5-bromo-2-methylanilino)-1H-indole-3-carbonitrile
CID 115146340
4-anilino-2-oxo-1H-1,7-naphthyridine-3-carbonitrile
CID 138518521
2-(2,2-dimethylpentylamino)-1H-indole-3-carbonitrile
CID 115146441
2-(pyridin-3-ylamino)pyridine-3-carbonitrile
CID 24708070
pyridin-3-ylcyanamide
CID 12652072
2-[(3-methylthiophen-2-yl)methylamino]-1H-indole-3-carbonitrile
CID 115146404
2-(pyridin-3-ylamino)pyridine-4-carbonitrile
CID 24702433
6-(pyridin-3-ylamino)pyridine-3-carbonitrile
CID 24690625
5-chloro-2-pyridin-3-yl-1H-indole-3-carbonitrile
CID 58215807
8,17-diazatricyclo[8.7.0.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaene
CID 151112967

Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile?
The IUPAC name of 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile (CID 115146342) is 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile.
What is the SMILES notation for 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile?
The canonical SMILES for 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile is N#Cc1c(Nc2cccnc2)[nH]c2ccccc12.
What is the InChIKey of 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile?
The InChIKey is SAHYQHCDULKVPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c15-8-12-11-5-1-2-6-13(11)18-14(12)17-10-4-3-7-16-9-10/h1-7,9,17-18H.
What are the key properties of 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile?
2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile has a molecular weight of 234.26 g/mol, XLogP of 3.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-3-ylamino)-1H-indole-3-carbonitrile is sourced from PubChem (CID 115146342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).