N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide

C17H13ClN2O2 — CID 24948900

IUPACN-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide
SMILESCc1c(C(=O)Nc2cccc(Cl)c2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C17H13ClN2O2/c1-10-13-7-2-3-8-14(13)20-17(22)15(10)16(21)19-12-6-4-5-11(18)9-12/h2-9H,1H3,(H,19,21)(H,20,22)
InChIKeyBLHIEISVYKDHLT-UHFFFAOYSA-N
MW312.76 g/mol
LogP3.74
Rot. Bonds2

About N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide

N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 24948900) has the molecular formula C17H13ClN2O2 and a molecular weight of 312.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide
PubChem CID24948900
Molecular FormulaC17H13ClN2O2
Molecular Weight312.76 g/mol
Exact Mass312.07
IUPAC NameN-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide
SMILESCc1c(C(=O)Nc2cccc(Cl)c2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C17H13ClN2O2/c1-10-13-7-2-3-8-14(13)20-17(22)15(10)16(21)19-12-6-4-5-11(18)9-12/h2-9H,1H3,(H,19,21)(H,20,22)
InChIKeyBLHIEISVYKDHLT-UHFFFAOYSA-N
XLogP3.74
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 ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chlorophenyl)-2,9-dioxo-1,4-dihydropyrazolo[5,1-b]quinazoline-3-carboxamide
CID 91283326
N-(3-ethylphenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
CID 54740490
3-acetyl-4-methyl-1H-quinolin-2-one
CID 102153269
N-[(2-chlorophenyl)methyl]-4-methyl-2-oxo-1H-quinoline-3-carboxamide
CID 24939142
N-(3-chlorophenyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31856117
3-methyl-N-(3-methylphenyl)-1H-indole-2-carboxamide
CID 113204253
N-(3-fluoro-4-methylphenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
CID 54706964
N-(3-acetylphenyl)-3-methyl-1H-indole-2-carboxamide
CID 110861099
N-(3-chlorophenyl)-2-hydroxynaphthalene-1-carboxamide
CID 19022893
N-(3-chlorophenyl)-3-(2,4-dioxo-1H-quinazolin-3-yl)propanamide
CID 4973826
N-[(1-hydroxycyclobutyl)methyl]-4-methyl-2-oxo-1H-quinoline-3-carboxamide
CID 111779687
N-(3-acetamidophenyl)-5-chloro-3-methyl-1H-indole-2-carboxamide
CID 113204770

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide (CID 24948900) is N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide is Cc1c(C(=O)Nc2cccc(Cl)c2)c(=O)[nH]c2ccccc12.
What is the InChIKey of N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is BLHIEISVYKDHLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O2/c1-10-13-7-2-3-8-14(13)20-17(22)15(10)16(21)19-12-6-4-5-11(18)9-12/h2-9H,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide?
N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 312.76 g/mol, XLogP of 3.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-4-methyl-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 24948900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).