6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one

C14H12FN3O — CID 134489898

IUPAC6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one
SMILESCc1cc(-c2cnc3c(c2)[nH]c(=O)n3C)ccc1F
InChIInChI=1S/C14H12FN3O/c1-8-5-9(3-4-11(8)15)10-6-12-13(16-7-10)18(2)14(19)17-12/h3-7H,1-2H3,(H,17,19)
InChIKeyQNLVUJNQNIPXFR-UHFFFAOYSA-N
MW257.27 g/mol
LogP2.38
Rot. Bonds1

About 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one

6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one (PubChem CID 134489898) has the molecular formula C14H12FN3O and a molecular weight of 257.27 g/mol. Its IUPAC name is 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one
PubChem CID134489898
Molecular FormulaC14H12FN3O
Molecular Weight257.27 g/mol
Exact Mass257.10
IUPAC Name6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one
SMILESCc1cc(-c2cnc3c(c2)[nH]c(=O)n3C)ccc1F
InChIInChI=1S/C14H12FN3O/c1-8-5-9(3-4-11(8)15)10-6-12-13(16-7-10)18(2)14(19)17-12/h3-7H,1-2H3,(H,17,19)
InChIKeyQNLVUJNQNIPXFR-UHFFFAOYSA-N
XLogP2.38
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.27
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[3-(difluoromethyl)-4-fluorophenyl]-3-methyl-1H-imidazo[4,5-b]pyridin-2-one
CID 134489921
3,6-dimethyl-1H-imidazo[4,5-b]pyridin-2-one
CID 14929592
6-(4-fluorophenyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
CID 110171943
6-(4-fluoro-3-methylphenyl)-3-methyl-1-(pyrimidin-5-ylmethyl)imidazo[4,5-b]pyridin-2-one
CID 134489949
3-chloro-6-(4-fluoro-3-methylphenyl)-1H-pyrrolo[3,2-b]pyridine
CID 140765188
6-(4-fluoro-3-methylphenyl)-1-(2-oxobutyl)-3H-imidazo[4,5-b]pyridin-2-one
CID 134493783
3-methyl-2-oxo-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 55263882
2-chloro-5-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid
CID 53222875
6-phenyl-3-propan-2-yl-1H-imidazo[4,5-b]pyridin-2-one
CID 164822523
4-(4-fluoro-3-methylphenyl)-1H-pyrazole
CID 118018809
1-[5-(4-fluoro-3-methylphenyl)-1H-imidazol-2-yl]ethanone
CID 116880620
5-(4-fluoro-3-methylphenyl)-1H-imidazole-2-carboxylic acid
CID 82079702

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one (CID 134489898) is 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one is Cc1cc(-c2cnc3c(c2)[nH]c(=O)n3C)ccc1F.
What is the InChIKey of 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is QNLVUJNQNIPXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3O/c1-8-5-9(3-4-11(8)15)10-6-12-13(16-7-10)18(2)14(19)17-12/h3-7H,1-2H3,(H,17,19).
What are the key properties of 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one?
6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 257.27 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluoro-3-methylphenyl)-3-methyl-1H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 134489898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).