6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile

C12H9N3O — CID 82470815

IUPAC6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile
SMILESCc1cc(-c2ccccn2)c(C#N)c(=O)[nH]1
InChIInChI=1S/C12H9N3O/c1-8-6-9(10(7-13)12(16)15-8)11-4-2-3-5-14-11/h2-6H,1H3,(H,15,16)
InChIKeyHKVOTJSBRMFWKT-UHFFFAOYSA-N
MW211.22 g/mol
LogP1.62
Rot. Bonds1

About 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile

6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile (PubChem CID 82470815) has the molecular formula C12H9N3O and a molecular weight of 211.22 g/mol. Its IUPAC name is 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile
PubChem CID82470815
Molecular FormulaC12H9N3O
Molecular Weight211.22 g/mol
Exact Mass211.07
IUPAC Name6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile
SMILESCc1cc(-c2ccccn2)c(C#N)c(=O)[nH]1
InChIInChI=1S/C12H9N3O/c1-8-6-9(10(7-13)12(16)15-8)11-4-2-3-5-14-11/h2-6H,1H3,(H,15,16)
InChIKeyHKVOTJSBRMFWKT-UHFFFAOYSA-N
XLogP1.62
TPSA69.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-oxo-4-(4-pyridin-2-ylphenyl)-1H-pyridine-3-carbonitrile
CID 168584768
6-methyl-4-[2-(4-methylphenyl)phenyl]-2-oxo-1H-pyridine-3-carbonitrile
CID 168584676
6-methyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-1H-pyridine-3-carbonitrile
CID 168584507
4-[2-(difluoromethyl)phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168585529
4-(3-cyanophenyl)-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168584520
4-[4-(5-cyano-2-pyridinyl)phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168585620
2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one
CID 18946451
4-(4-bromophenyl)-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 947694
3-(3-cyano-6-methyl-2-oxo-1H-pyridin-4-yl)benzoic acid
CID 168585684
4-[3-(2-fluorophenyl)phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168584670
4-[2-[(dimethylamino)methyl]phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168586524
6-methyl-4-[2-(5-methylfuran-2-yl)phenyl]-2-oxo-1H-pyridine-3-carbonitrile
CID 168587408

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile?
The IUPAC name of 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile (CID 82470815) is 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile.
What is the SMILES notation for 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile?
The canonical SMILES for 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile is Cc1cc(-c2ccccn2)c(C#N)c(=O)[nH]1.
What is the InChIKey of 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile?
The InChIKey is HKVOTJSBRMFWKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O/c1-8-6-9(10(7-13)12(16)15-8)11-4-2-3-5-14-11/h2-6H,1H3,(H,15,16).
What are the key properties of 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile?
6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile has a molecular weight of 211.22 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile is sourced from PubChem (CID 82470815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).