N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide

C17H12BrClN2O2 — CID 43833238

IUPACN-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
SMILESO=C(Cn1ccc(=O)c2cc(Cl)ccc21)Nc1ccc(Br)cc1
InChIInChI=1S/C17H12BrClN2O2/c18-11-1-4-13(5-2-11)20-17(23)10-21-8-7-16(22)14-9-12(19)3-6-15(14)21/h1-9H,10H2,(H,20,23)
InChIKeyYYXQBUQOWRTYMZ-UHFFFAOYSA-N
MW391.65 g/mol
LogP4.06
Rot. Bonds3

About N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide

N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide (PubChem CID 43833238) has the molecular formula C17H12BrClN2O2 and a molecular weight of 391.65 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
PubChem CID43833238
Molecular FormulaC17H12BrClN2O2
Molecular Weight391.65 g/mol
Exact Mass389.98
IUPAC NameN-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
SMILESO=C(Cn1ccc(=O)c2cc(Cl)ccc21)Nc1ccc(Br)cc1
InChIInChI=1S/C17H12BrClN2O2/c18-11-1-4-13(5-2-11)20-17(23)10-21-8-7-16(22)14-9-12(19)3-6-15(14)21/h1-9H,10H2,(H,20,23)
InChIKeyYYXQBUQOWRTYMZ-UHFFFAOYSA-N
XLogP4.06
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.65
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-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-(4-chlorophenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741578
2-(7-chloro-4-oxoquinolin-1-yl)-N-(4-chlorophenyl)acetamide
CID 100738455
N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 100735847
2-[4-[[2-(6-bromo-4-oxoquinolin-1-yl)acetyl]amino]phenyl]acetamide
CID 100779672
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,4-dichlorophenyl)acetamide
CID 100735074
2-(6-bromo-4-oxoquinolin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
CID 100736984
2-(5-bromoindol-1-yl)-N-(4-bromophenyl)acetamide
CID 4291378
ethyl 2-[4-[[2-(6-bromo-4-oxoquinolin-1-yl)acetyl]amino]phenyl]acetate
CID 100779669
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 100734930
2-(7-chloro-4-oxoquinolin-1-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 100738649
2-(6-bromo-4-oxoquinolin-1-yl)-N-ethylacetamide
CID 100736017
N-butyl-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 100734647

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide (CID 43833238) is N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide is O=C(Cn1ccc(=O)c2cc(Cl)ccc21)Nc1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The InChIKey is YYXQBUQOWRTYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12BrClN2O2/c18-11-1-4-13(5-2-11)20-17(23)10-21-8-7-16(22)14-9-12(19)3-6-15(14)21/h1-9H,10H2,(H,20,23).
What are the key properties of N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide has a molecular weight of 391.65 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 43833238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).