8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide

C18H15ClN2O3 — CID 43831924

IUPAC8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide
SMILESCOc1cccc(NC(=O)c2cn(C)c3c(Cl)cccc3c2=O)c1
InChIInChI=1S/C18H15ClN2O3/c1-21-10-14(17(22)13-7-4-8-15(19)16(13)21)18(23)20-11-5-3-6-12(9-11)24-2/h3-10H,1-2H3,(H,20,23)
InChIKeyKZTQZJQUCYTCBT-UHFFFAOYSA-N
MW342.78 g/mol
LogP3.45
Rot. Bonds3

About 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide

8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide (PubChem CID 43831924) has the molecular formula C18H15ClN2O3 and a molecular weight of 342.78 g/mol. Its IUPAC name is 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide.

Molecular Properties

Compound Name8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide
PubChem CID43831924
Molecular FormulaC18H15ClN2O3
Molecular Weight342.78 g/mol
Exact Mass342.08
IUPAC Name8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide
SMILESCOc1cccc(NC(=O)c2cn(C)c3c(Cl)cccc3c2=O)c1
InChIInChI=1S/C18H15ClN2O3/c1-21-10-14(17(22)13-7-4-8-15(19)16(13)21)18(23)20-11-5-3-6-12(9-11)24-2/h3-10H,1-2H3,(H,20,23)
InChIKeyKZTQZJQUCYTCBT-UHFFFAOYSA-N
XLogP3.45
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.78
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-bromophenyl)-8-chloro-1-methyl-4-oxoquinoline-3-carboxamide
CID 43831943
8-chloro-N-(4-fluorophenyl)-1-methyl-4-oxoquinoline-3-carboxamide
CID 43831923
N-(4-acetylphenyl)-8-chloro-1-methyl-4-oxoquinoline-3-carboxamide
CID 43831914
2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide
CID 886020
2-chloro-N-(3-methoxyphenyl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26914552
2-chloro-N-(3-methoxyphenyl)-5-piperidin-1-ylsulfonylbenzamide
CID 26914652
3-chloro-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 66462058
5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide
CID 107183164
2,3-dimethoxy-N-(3-methoxyphenyl)benzamide
CID 912443
5-chloro-4-iodo-2-methoxy-N-(3-methoxyphenyl)benzamide
CID 52577352
3,6-dichloro-N-(3-methoxyphenyl)pyridazine-4-carboxamide
CID 6405267
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303

Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide?
The IUPAC name of 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide (CID 43831924) is 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide.
What is the SMILES notation for 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide?
The canonical SMILES for 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide is COc1cccc(NC(=O)c2cn(C)c3c(Cl)cccc3c2=O)c1.
What is the InChIKey of 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide?
The InChIKey is KZTQZJQUCYTCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O3/c1-21-10-14(17(22)13-7-4-8-15(19)16(13)21)18(23)20-11-5-3-6-12(9-11)24-2/h3-10H,1-2H3,(H,20,23).
What are the key properties of 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide?
8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide has a molecular weight of 342.78 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-(3-methoxyphenyl)-1-methyl-4-oxoquinoline-3-carboxamide is sourced from PubChem (CID 43831924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).