7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one

C20H15F2N3O2 — CID 70728101

IUPAC7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one
SMILESCOc1ccc(F)c(F)c1-c1nccn1-c1ccc2c(C)cc(=O)[nH]c2c1
InChIInChI=1S/C20H15F2N3O2/c1-11-9-17(26)24-15-10-12(3-4-13(11)15)25-8-7-23-20(25)18-16(27-2)6-5-14(21)19(18)22/h3-10H,1-2H3,(H,24,26)
InChIKeyPWAGGYZBYAMHGT-UHFFFAOYSA-N
MW367.36 g/mol
LogP3.98
Rot. Bonds3

About 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one

7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one (PubChem CID 70728101) has the molecular formula C20H15F2N3O2 and a molecular weight of 367.36 g/mol. Its IUPAC name is 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one.

Molecular Properties

Compound Name7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one
PubChem CID70728101
Molecular FormulaC20H15F2N3O2
Molecular Weight367.36 g/mol
Exact Mass367.11
IUPAC Name7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one
SMILESCOc1ccc(F)c(F)c1-c1nccn1-c1ccc2c(C)cc(=O)[nH]c2c1
InChIInChI=1S/C20H15F2N3O2/c1-11-9-17(26)24-15-10-12(3-4-13(11)15)25-8-7-23-20(25)18-16(27-2)6-5-14(21)19(18)22/h3-10H,1-2H3,(H,24,26)
InChIKeyPWAGGYZBYAMHGT-UHFFFAOYSA-N
XLogP3.98
TPSA59.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.36
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]phenyl]-1,2,4-triazole
CID 56899429
4-methyl-7-[2-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]-1H-quinolin-2-one
CID 70707342
6-[2-(4-methoxy-3-methylphenyl)imidazol-1-yl]quinoxaline
CID 56880029
2-(2,6-dimethoxyphenyl)-1-(5-fluoro-2-methylphenyl)imidazole
CID 56745803
4-[[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]methyl]-1-methylpyrrolidin-2-one
CID 146042997
1-(4-fluoro-3-methylphenyl)imidazol-2-amine
CID 106570575
4-[5-(2,3-difluoro-6-methoxyphenyl)-3-methyl-1,2,4-triazol-1-yl]-2-methylpyridine
CID 74247116
1-(3-methoxy-4-propan-2-ylphenyl)-2-phenylimidazole
CID 156877703
7-ethoxy-4-methyl-1H-quinolin-2-one
CID 121226556
5-[3-[[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]methyl]phenyl]-2H-tetrazole
CID 86282902
(1S,2R,6S,7R,8S,10R)-4-(4-methyl-2-oxo-1H-quinolin-7-yl)-4-azatetracyclo[5.3.1.02,6.08,10]undecane-3,5-dione
CID 68542059
2-methoxy-5-(2-methylimidazol-1-yl)benzoic acid
CID 82513098

Frequently Asked Questions

What is the IUPAC name of 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one?
The IUPAC name of 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one (CID 70728101) is 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one.
What is the SMILES notation for 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one?
The canonical SMILES for 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one is COc1ccc(F)c(F)c1-c1nccn1-c1ccc2c(C)cc(=O)[nH]c2c1.
What is the InChIKey of 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one?
The InChIKey is PWAGGYZBYAMHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3O2/c1-11-9-17(26)24-15-10-12(3-4-13(11)15)25-8-7-23-20(25)18-16(27-2)6-5-14(21)19(18)22/h3-10H,1-2H3,(H,24,26).
What are the key properties of 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one?
7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one has a molecular weight of 367.36 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(2,3-difluoro-6-methoxyphenyl)imidazol-1-yl]-4-methyl-1H-quinolin-2-one is sourced from PubChem (CID 70728101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).