4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one

C14H13N3O2 — CID 54684907

IUPAC4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one
SMILESCc1nc2ccc(-n3c(C)cc(O)cc3=O)cc2[nH]1
InChIInChI=1S/C14H13N3O2/c1-8-5-11(18)7-14(19)17(8)10-3-4-12-13(6-10)16-9(2)15-12/h3-7,18H,1-2H3,(H,15,16)
InChIKeyYVOAIEQVMRZDMT-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.04
Rot. Bonds1

About 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one

4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one (PubChem CID 54684907) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one
PubChem CID54684907
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC Name4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one
SMILESCc1nc2ccc(-n3c(C)cc(O)cc3=O)cc2[nH]1
InChIInChI=1S/C14H13N3O2/c1-8-5-11(18)7-14(19)17(8)10-3-4-12-13(6-10)16-9(2)15-12/h3-7,18H,1-2H3,(H,15,16)
InChIKeyYVOAIEQVMRZDMT-UHFFFAOYSA-N
XLogP2.04
TPSA70.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3H-benzimidazol-5-yl)-4-hydroxy-6-methylpyridin-2-one
CID 54708010
2-methyl-6-(4-methylsulfonylpiperazin-1-yl)-1H-benzimidazole
CID 110643427
2-methyl-6-piperazin-1-yl-1H-benzimidazole
CID 20580687
1-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl]-4-hydroxy-6-methylpyridin-2-one
CID 134716801
2-methyl-3H-benzimidazole-5-thiol
CID 43154899
(2-methyl-3H-benzimidazol-5-yl)boronic acid
CID 119084623
N,2-dimethyl-3H-benzimidazole-5-carbohydrazide
CID 116845661
(3,4-dimethylphenyl)-[4-(2-methyl-3H-benzimidazol-5-yl)piperazin-1-yl]methanone
CID 110643379
ethane;6-fluoro-2-methyl-1H-benzimidazole
CID 142961640
2-[methyl-(2-methyl-3H-benzimidazol-5-yl)amino]-2-oxoacetic acid
CID 115141265
methylamino-(2-methyl-3H-benzimidazol-5-yl)methanol
CID 116954709
2-(methylamino)-1-(2-methyl-3H-benzimidazol-5-yl)propan-1-one
CID 82493358

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one (CID 54684907) is 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one is Cc1nc2ccc(-n3c(C)cc(O)cc3=O)cc2[nH]1.
What is the InChIKey of 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one?
The InChIKey is YVOAIEQVMRZDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c1-8-5-11(18)7-14(19)17(8)10-3-4-12-13(6-10)16-9(2)15-12/h3-7,18H,1-2H3,(H,15,16).
What are the key properties of 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one?
4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one has a molecular weight of 255.28 g/mol, XLogP of 2.04, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-1-(2-methyl-3H-benzimidazol-5-yl)pyridin-2-one is sourced from PubChem (CID 54684907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).