N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide

C18H14Cl2N2O2 — CID 43832718

IUPACN-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
SMILESCc1c(Cl)cccc1NC(=O)Cn1ccc(=O)c2cc(Cl)ccc21
InChIInChI=1S/C18H14Cl2N2O2/c1-11-14(20)3-2-4-15(11)21-18(24)10-22-8-7-17(23)13-9-12(19)5-6-16(13)22/h2-9H,10H2,1H3,(H,21,24)
InChIKeySSJPFJRWQZCEIK-UHFFFAOYSA-N
MW361.23 g/mol
LogP4.26
Rot. Bonds3

About N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide

N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide (PubChem CID 43832718) has the molecular formula C18H14Cl2N2O2 and a molecular weight of 361.23 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
PubChem CID43832718
Molecular FormulaC18H14Cl2N2O2
Molecular Weight361.23 g/mol
Exact Mass360.04
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
SMILESCc1c(Cl)cccc1NC(=O)Cn1ccc(=O)c2cc(Cl)ccc21
InChIInChI=1S/C18H14Cl2N2O2/c1-11-14(20)3-2-4-15(11)21-18(24)10-22-8-7-17(23)13-9-12(19)5-6-16(13)22/h2-9H,10H2,1H3,(H,21,24)
InChIKeySSJPFJRWQZCEIK-UHFFFAOYSA-N
XLogP4.26
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.23
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,4-dichlorophenyl)acetamide
CID 100735074
N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741423
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 100734930
N-(3-acetamidophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 100735847
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2-ethyl-6-methylphenyl)acetamide
CID 100734953
2-(6-chloro-4-oxoquinolin-1-yl)-N-[(2-chlorophenyl)methyl]acetamide
CID 100734816
N-(4-chlorophenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741578
N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 43833238
N-(3-chloro-2-fluorophenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47780650
N-butyl-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 100734647
N-(3-chloro-2-methylphenyl)-2-(2,6-dimethyl-4-oxo-1-pyridinyl)acetamide
CID 108794883
1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2-oxopyridine-3-carboxylic acid
CID 82107998

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide (CID 43832718) is N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide is Cc1c(Cl)cccc1NC(=O)Cn1ccc(=O)c2cc(Cl)ccc21.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
The InChIKey is SSJPFJRWQZCEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2O2/c1-11-14(20)3-2-4-15(11)21-18(24)10-22-8-7-17(23)13-9-12(19)5-6-16(13)22/h2-9H,10H2,1H3,(H,21,24).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide?
N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide has a molecular weight of 361.23 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 43832718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).