2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one

C12H12N2O — CID 18946451

IUPAC2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one
SMILESCc1cc(=O)c(-c2ccccn2)c(C)[nH]1
InChIInChI=1S/C12H12N2O/c1-8-7-11(15)12(9(2)14-8)10-5-3-4-6-13-10/h3-7H,1-2H3,(H,14,15)
InChIKeyVXEWSEWLZLCYIH-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.05
Rot. Bonds1

About 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one

2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one (PubChem CID 18946451) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one.

Molecular Properties

Compound Name2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one
PubChem CID18946451
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one
SMILESCc1cc(=O)c(-c2ccccn2)c(C)[nH]1
InChIInChI=1S/C12H12N2O/c1-8-7-11(15)12(9(2)14-8)10-5-3-4-6-13-10/h3-7H,1-2H3,(H,14,15)
InChIKeyVXEWSEWLZLCYIH-UHFFFAOYSA-N
XLogP2.05
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-2-oxo-4-pyridin-2-yl-1H-pyridine-3-carbonitrile
CID 82470815
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CID 172801598
5-methyl-4-pyridin-2-yl-3H-1,3-thiazol-2-one
CID 55265010
6-methyl-2-oxo-4-(4-pyridin-2-ylphenyl)-1H-pyridine-3-carbonitrile
CID 168584768
2-(2,4,6-trimethyl-3-pyridin-2-ylphenyl)pyridine
CID 140909024
2,6-dimethyl-3-[6-[4-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyridin-4-one
CID 70989962
3-[(1S)-1-hydroxyethyl]-6-pyridin-2-yl-1H-pyridin-2-one
CID 129448586
2-methyl-1H-1,8-naphthyridin-4-one;propane
CID 142119860
3,5-dimethyl-1H-pyrazole;2-(3-pyridin-2-ylphenyl)pyridine
CID 159490451
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
cobalt;ethane;tris(2-pyridin-2-ylpyridine)
CID 161013986
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CID 142993468

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one?
The IUPAC name of 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one (CID 18946451) is 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one.
What is the SMILES notation for 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one?
The canonical SMILES for 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one is Cc1cc(=O)c(-c2ccccn2)c(C)[nH]1.
What is the InChIKey of 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one?
The InChIKey is VXEWSEWLZLCYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-8-7-11(15)12(9(2)14-8)10-5-3-4-6-13-10/h3-7H,1-2H3,(H,14,15).
What are the key properties of 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one?
2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one has a molecular weight of 200.24 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-3-pyridin-2-yl-1H-pyridin-4-one is sourced from PubChem (CID 18946451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).