6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one

C19H16F2N4O2 — CID 134490168

IUPAC6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one
SMILESCc1cc(Cn2c(=O)n(C)c3ncc(-c4ccc(F)c(C)c4F)cc32)no1
InChIInChI=1S/C19H16F2N4O2/c1-10-6-13(23-27-10)9-25-16-7-12(8-22-18(16)24(3)19(25)26)14-4-5-15(20)11(2)17(14)21/h4-8H,9H2,1-3H3
InChIKeyZJIQFZZSUZGCLX-UHFFFAOYSA-N
MW370.36 g/mol
LogP3.33
Rot. Bonds3

About 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one

6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one (PubChem CID 134490168) has the molecular formula C19H16F2N4O2 and a molecular weight of 370.36 g/mol. Its IUPAC name is 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one
PubChem CID134490168
Molecular FormulaC19H16F2N4O2
Molecular Weight370.36 g/mol
Exact Mass370.12
IUPAC Name6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one
SMILESCc1cc(Cn2c(=O)n(C)c3ncc(-c4ccc(F)c(C)c4F)cc32)no1
InChIInChI=1S/C19H16F2N4O2/c1-10-6-13(23-27-10)9-25-16-7-12(8-22-18(16)24(3)19(25)26)14-4-5-15(20)11(2)17(14)21/h4-8H,9H2,1-3H3
InChIKeyZJIQFZZSUZGCLX-UHFFFAOYSA-N
XLogP3.33
TPSA65.85 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.36
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one (CID 134490168) is 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one is Cc1cc(Cn2c(=O)n(C)c3ncc(-c4ccc(F)c(C)c4F)cc32)no1.
What is the InChIKey of 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?
The InChIKey is ZJIQFZZSUZGCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N4O2/c1-10-6-13(23-27-10)9-25-16-7-12(8-22-18(16)24(3)19(25)26)14-4-5-15(20)11(2)17(14)21/h4-8H,9H2,1-3H3.
What are the key properties of 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one?
6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one has a molecular weight of 370.36 g/mol, XLogP of 3.33, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-difluoro-3-methylphenyl)-3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 134490168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).