N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide

C17H13ClN2O2 — CID 44561346

IUPACN-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide
SMILESCC(=O)Nc1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O
InChIInChI=1S/C17H13ClN2O2/c1-10(21)19-16-15(11-5-3-2-4-6-11)13-9-12(18)7-8-14(13)20-17(16)22/h2-9H,1H3,(H,19,21)(H,20,22)
InChIKeyCFMOUJRBWKDBNG-UHFFFAOYSA-N
MW312.76 g/mol
LogP3.81
Rot. Bonds2

About N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide

N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide (PubChem CID 44561346) has the molecular formula C17H13ClN2O2 and a molecular weight of 312.76 g/mol. Its IUPAC name is N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide
PubChem CID44561346
Molecular FormulaC17H13ClN2O2
Molecular Weight312.76 g/mol
Exact Mass312.07
IUPAC NameN-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide
SMILESCC(=O)Nc1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O
InChIInChI=1S/C17H13ClN2O2/c1-10(21)19-16-15(11-5-3-2-4-6-11)13-9-12(18)7-8-14(13)20-17(16)22/h2-9H,1H3,(H,19,21)(H,20,22)
InChIKeyCFMOUJRBWKDBNG-UHFFFAOYSA-N
XLogP3.81
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.76
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)acetamide
CID 10686612
(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl) acetate
CID 174726646
6-chloro-3-(dimethylamino)-4-phenyl-1H-quinolin-2-one
CID 3446328
N-(6-chloro-1-methyl-2-oxo-4-phenylquinolin-3-yl)acetamide
CID 11727151
methyl 2-[(7-chloro-2-oxo-3-phenyl-1H-quinolin-4-yl)amino]-2-oxoacetate
CID 10594476
2-chloro-N-(2-oxo-4-phenyl-1H-quinolin-3-yl)benzamide
CID 10619449
3-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]propanoic acid
CID 4157880
6-chloro-4-phenyl-3-pyrrolidin-1-yl-1H-quinolin-2-one
CID 715752
6-chloro-3-[(E)-3-(2-chloro-6-fluorophenyl)but-2-enoyl]-4-phenyl-1H-quinolin-2-one
CID 86300874
6-chloro-3-[3-(2-methylphenyl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one
CID 4668889
ethyl 3-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)benzoate
CID 59654994
6-chloro-3-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-4-phenyl-1H-quinolin-2-one
CID 1421862

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide?
The IUPAC name of N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide (CID 44561346) is N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide.
What is the SMILES notation for N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide?
The canonical SMILES for N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide is CC(=O)Nc1c(-c2ccccc2)c2cc(Cl)ccc2[nH]c1=O.
What is the InChIKey of N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide?
The InChIKey is CFMOUJRBWKDBNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O2/c1-10(21)19-16-15(11-5-3-2-4-6-11)13-9-12(18)7-8-14(13)20-17(16)22/h2-9H,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide?
N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide has a molecular weight of 312.76 g/mol, XLogP of 3.81, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)acetamide is sourced from PubChem (CID 44561346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).