7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide

C17H15N3O2 — CID 110668417

IUPAC7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide
SMILESCc1cc2ccc(N)cc2n(C(=O)Nc2ccccc2)c1=O
InChIInChI=1S/C17H15N3O2/c1-11-9-12-7-8-13(18)10-15(12)20(16(11)21)17(22)19-14-5-3-2-4-6-14/h2-10H,18H2,1H3,(H,19,22)
InChIKeyUNEFNDMGCNMKHI-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.97
Rot. Bonds1

About 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide

7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide (PubChem CID 110668417) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide.

Molecular Properties

Compound Name7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide
PubChem CID110668417
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide
SMILESCc1cc2ccc(N)cc2n(C(=O)Nc2ccccc2)c1=O
InChIInChI=1S/C17H15N3O2/c1-11-9-12-7-8-13(18)10-15(12)20(16(11)21)17(22)19-14-5-3-2-4-6-14/h2-10H,18H2,1H3,(H,19,22)
InChIKeyUNEFNDMGCNMKHI-UHFFFAOYSA-N
XLogP2.97
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-acetyl-7-amino-3-methylquinolin-2-one
CID 110668267
7-amino-3-methyl-1-propanoylquinolin-2-one
CID 110668268
7-amino-3-methyl-1-(2,3,4-trifluorobenzoyl)quinolin-2-one
CID 110668318
7-amino-1-(5-bromofuran-2-carbonyl)-3-methylquinolin-2-one
CID 110668257
5-methyl-N,2-diphenylindole-1-carboxamide
CID 25170726
2-(3-methyl-2-oxoquinolin-1-yl)-N-(4-methylphenyl)acetamide
CID 110680370
aniline;phenylcarbamic acid
CID 173402321
2-(5-amino-2-methylphenyl)sulfonyl-N-phenylacetamide
CID 81193245
3-methyl-N-phenylnaphthalene-2-carboxamide
CID 90742280
N-(4-acetylphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
CID 110680389
5-amino-N-(4-chlorophenyl)-6-methyl-2-oxo-3H-benzimidazole-1-carboxamide
CID 110874390
3-methyl-2-oxo-1-phenylquinoline-6-carboxamide
CID 174975874

Frequently Asked Questions

What is the IUPAC name of 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide?
The IUPAC name of 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide (CID 110668417) is 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide.
What is the SMILES notation for 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide?
The canonical SMILES for 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide is Cc1cc2ccc(N)cc2n(C(=O)Nc2ccccc2)c1=O.
What is the InChIKey of 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide?
The InChIKey is UNEFNDMGCNMKHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-11-9-12-7-8-13(18)10-15(12)20(16(11)21)17(22)19-14-5-3-2-4-6-14/h2-10H,18H2,1H3,(H,19,22).
What are the key properties of 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide?
7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.97, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-3-methyl-2-oxo-N-phenylquinoline-1-carboxamide is sourced from PubChem (CID 110668417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).