N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide

C18H17N3O3 — CID 110703065

IUPACN-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
SMILESCN1C(=O)CC(C(=O)Nc2ccccc2C(N)=O)c2ccccc21
InChIInChI=1S/C18H17N3O3/c1-21-15-9-5-3-6-11(15)13(10-16(21)22)18(24)20-14-8-4-2-7-12(14)17(19)23/h2-9,13H,10H2,1H3,(H2,19,23)(H,20,24)
InChIKeyBSIPSZCFYFIMFQ-UHFFFAOYSA-N
MW323.35 g/mol
LogP1.87
Rot. Bonds3

About N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide

N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide (PubChem CID 110703065) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
PubChem CID110703065
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
SMILESCN1C(=O)CC(C(=O)Nc2ccccc2C(N)=O)c2ccccc21
InChIInChI=1S/C18H17N3O3/c1-21-15-9-5-3-6-11(15)13(10-16(21)22)18(24)20-14-8-4-2-7-12(14)17(19)23/h2-9,13H,10H2,1H3,(H2,19,23)(H,20,24)
InChIKeyBSIPSZCFYFIMFQ-UHFFFAOYSA-N
XLogP1.87
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(2-methylphenyl)-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703022
N-(3-acetamidophenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703069
N-(3-chloro-4-methylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110703047
N-[2-(dimethylamino)ethyl]-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 110702966
1-methyl-2-oxo-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]-3,4-dihydroquinoline-4-carboxamide
CID 146139808
(3R)-N-(2-carbamoylphenyl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 9401166
N-[1-(3,4-difluorophenyl)ethyl]-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 75459992
N-(2-carbamoylphenyl)-1-methylsulfonylazetidine-3-carboxamide
CID 90513266
2-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)amino]ethylurea
CID 83110177
11-methyl-N-(4-methylphenyl)-5,6-dihydrobenzo[b][1]benzazepine-5-carboxamide
CID 4197491
(4S)-1-methyl-N-[(1R,2R)-1-morpholin-4-yl-2,3-dihydro-1H-inden-2-yl]-2-oxo-3,4-dihydroquinoline-4-carboxamide
CID 134330963
N-(2-carbamoylphenyl)-1-(3,4-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 17082354

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide (CID 110703065) is N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide is CN1C(=O)CC(C(=O)Nc2ccccc2C(N)=O)c2ccccc21.
What is the InChIKey of N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide?
The InChIKey is BSIPSZCFYFIMFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-21-15-9-5-3-6-11(15)13(10-16(21)22)18(24)20-14-8-4-2-7-12(14)17(19)23/h2-9,13H,10H2,1H3,(H2,19,23)(H,20,24).
What are the key properties of N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide?
N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide has a molecular weight of 323.35 g/mol, XLogP of 1.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-1-methyl-2-oxo-3,4-dihydroquinoline-4-carboxamide is sourced from PubChem (CID 110703065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).