2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile

C12H9N3 — CID 121008779

IUPAC2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile
SMILESN#CCc1ccc(-c2ccccn2)nc1
InChIInChI=1S/C12H9N3/c13-7-6-10-4-5-12(15-9-10)11-3-1-2-8-14-11/h1-5,8-9H,6H2
InChIKeyGEBSBVXQCFLTDM-UHFFFAOYSA-N
MW195.22 g/mol
LogP2.21
Rot. Bonds2

About 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile

2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile (PubChem CID 121008779) has the molecular formula C12H9N3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile.

Molecular Properties

Compound Name2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile
PubChem CID121008779
Molecular FormulaC12H9N3
Molecular Weight195.22 g/mol
Exact Mass195.08
IUPAC Name2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile
SMILESN#CCc1ccc(-c2ccccn2)nc1
InChIInChI=1S/C12H9N3/c13-7-6-10-4-5-12(15-9-10)11-3-1-2-8-14-11/h1-5,8-9H,6H2
InChIKeyGEBSBVXQCFLTDM-UHFFFAOYSA-N
XLogP2.21
TPSA49.57 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-2-yl-5-[2-(6-pyridin-2-yl-3-pyridinyl)ethyl]pyridine
CID 102191368
5-(methoxymethyl)-2-pyridin-2-ylpyridine
CID 58454942
ethane;5-ethyl-2-pyridin-2-ylpyridine
CID 143067787
2-[6-(2,3,4,5,6-pentafluorophenyl)-3-pyridinyl]acetonitrile
CID 118815019
2-[6-(2-methoxyphenyl)-3-pyridinyl]acetonitrile
CID 117001949
2-(2-pyridin-2-ylphenyl)acetonitrile
CID 53446408
disodium;hydride;2-pyridin-2-ylpyridine
CID 174959125
3-(6-pyridin-2-yl-3-pyridinyl)propanoic acid
CID 121355469
2-[6-(4-tert-butylphenyl)-3-pyridinyl]acetonitrile
CID 67155708
cobalt(2+);bis(2-pyridin-2-ylpyridine);dicyanate
CID 139074463
CID 101437421
CID 101437421
2-pyridin-2-yl-5-(2-pyrrol-1-ylethoxymethyl)pyridine
CID 102140816

Frequently Asked Questions

What is the IUPAC name of 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile?
The IUPAC name of 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile (CID 121008779) is 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile.
What is the SMILES notation for 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile?
The canonical SMILES for 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile is N#CCc1ccc(-c2ccccn2)nc1.
What is the InChIKey of 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile?
The InChIKey is GEBSBVXQCFLTDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3/c13-7-6-10-4-5-12(15-9-10)11-3-1-2-8-14-11/h1-5,8-9H,6H2.
What are the key properties of 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile?
2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile has a molecular weight of 195.22 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyridin-2-yl-3-pyridinyl)acetonitrile is sourced from PubChem (CID 121008779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).