6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile

C11H6N4 — CID 114650786

IUPAC6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-n2cccc2C#N)nc1
InChIInChI=1S/C11H6N4/c12-6-9-3-4-11(14-8-9)15-5-1-2-10(15)7-13/h1-5,8H
InChIKeyGYPSNCNPYSDWRC-UHFFFAOYSA-N
MW194.20 g/mol
LogP1.62
Rot. Bonds1

About 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile

6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile (PubChem CID 114650786) has the molecular formula C11H6N4 and a molecular weight of 194.20 g/mol. Its IUPAC name is 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile
PubChem CID114650786
Molecular FormulaC11H6N4
Molecular Weight194.20 g/mol
Exact Mass194.06
IUPAC Name6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-n2cccc2C#N)nc1
InChIInChI=1S/C11H6N4/c12-6-9-3-4-11(14-8-9)15-5-1-2-10(15)7-13/h1-5,8H
InChIKeyGYPSNCNPYSDWRC-UHFFFAOYSA-N
XLogP1.62
TPSA65.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.20
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-bromo-2-pyridinyl)pyrrole-2-carbonitrile
CID 114652110
1-pyridin-2-ylpyrrole-2-carbonitrile
CID 114653179
6-(2-methylimidazol-1-yl)pyridine-3-carbonitrile
CID 24701707
1-(2-chloro-4-cyanophenyl)pyrrole-2-carbonitrile
CID 114650817
6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile
CID 67042730
5-chloro-2-(2-cyanopyrrol-1-yl)pyridine-4-carboxylic acid
CID 114916771
1-(3-chloro-2-pyridinyl)pyrrole-2-carbonitrile
CID 114653245
6-(2,5-dioxopyrrolidin-1-yl)pyridine-3-carbonitrile
CID 71813200
1-(3-amino-2-pyridinyl)pyrrole-2-carbonitrile
CID 114649836
6-(5-pyridin-2-yl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl)pyridine-3-carbonitrile
CID 163351951
1-(4,6-dimethylpyrimidin-2-yl)pyrrole-2-carbonitrile
CID 114653466
methyl 4-(2-cyanopyrrol-1-yl)pyrimidine-2-carboxylate
CID 114653271

Frequently Asked Questions

What is the IUPAC name of 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile?
The IUPAC name of 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile (CID 114650786) is 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile?
The canonical SMILES for 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile is N#Cc1ccc(-n2cccc2C#N)nc1.
What is the InChIKey of 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile?
The InChIKey is GYPSNCNPYSDWRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6N4/c12-6-9-3-4-11(14-8-9)15-5-1-2-10(15)7-13/h1-5,8H.
What are the key properties of 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile?
6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile has a molecular weight of 194.20 g/mol, XLogP of 1.62, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 114650786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).