7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one

C21H15FN4O2 — CID 52933807

IUPAC7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one
SMILESCc1noc(C)c1-c1ccc2c(c1)ncc1[nH]c(=O)n(-c3ccccc3F)c12
InChIInChI=1S/C21H15FN4O2/c1-11-19(12(2)28-25-11)13-7-8-14-16(9-13)23-10-17-20(14)26(21(27)24-17)18-6-4-3-5-15(18)22/h3-10H,1-2H3,(H,24,27)
InChIKeyZNMIQIQJWHERGU-UHFFFAOYSA-N
MW374.38 g/mol
LogP4.28
Rot. Bonds2

About 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one

7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one (PubChem CID 52933807) has the molecular formula C21H15FN4O2 and a molecular weight of 374.38 g/mol. Its IUPAC name is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one
PubChem CID52933807
Molecular FormulaC21H15FN4O2
Molecular Weight374.38 g/mol
Exact Mass374.12
IUPAC Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one
SMILESCc1noc(C)c1-c1ccc2c(c1)ncc1[nH]c(=O)n(-c3ccccc3F)c12
InChIInChI=1S/C21H15FN4O2/c1-11-19(12(2)28-25-11)13-7-8-14-16(9-13)23-10-17-20(14)26(21(27)24-17)18-6-4-3-5-15(18)22/h3-10H,1-2H3,(H,24,27)
InChIKeyZNMIQIQJWHERGU-UHFFFAOYSA-N
XLogP4.28
TPSA76.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.38
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one (CID 52933807) is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one is Cc1noc(C)c1-c1ccc2c(c1)ncc1[nH]c(=O)n(-c3ccccc3F)c12.
What is the InChIKey of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one?
The InChIKey is ZNMIQIQJWHERGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN4O2/c1-11-19(12(2)28-25-11)13-7-8-14-16(9-13)23-10-17-20(14)26(21(27)24-17)18-6-4-3-5-15(18)22/h3-10H,1-2H3,(H,24,27).
What are the key properties of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one?
7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one has a molecular weight of 374.38 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 52933807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).