3-methyl-2-oxo-1-phenylquinoline-6-carboxamide

C17H14N2O2 — CID 174975874

IUPAC3-methyl-2-oxo-1-phenylquinoline-6-carboxamide
SMILESCc1cc2cc(C(N)=O)ccc2n(-c2ccccc2)c1=O
InChIInChI=1S/C17H14N2O2/c1-11-9-13-10-12(16(18)20)7-8-15(13)19(17(11)21)14-5-3-2-4-6-14/h2-10H,1H3,(H2,18,20)
InChIKeyXIWVKFNKBKTJFM-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.40
Rot. Bonds2

About 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide

3-methyl-2-oxo-1-phenylquinoline-6-carboxamide (PubChem CID 174975874) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide.

Molecular Properties

Compound Name3-methyl-2-oxo-1-phenylquinoline-6-carboxamide
PubChem CID174975874
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name3-methyl-2-oxo-1-phenylquinoline-6-carboxamide
SMILESCc1cc2cc(C(N)=O)ccc2n(-c2ccccc2)c1=O
InChIInChI=1S/C17H14N2O2/c1-11-9-13-10-12(16(18)20)7-8-15(13)19(17(11)21)14-5-3-2-4-6-14/h2-10H,1H3,(H2,18,20)
InChIKeyXIWVKFNKBKTJFM-UHFFFAOYSA-N
XLogP2.40
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide?
The IUPAC name of 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide (CID 174975874) is 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide.
What is the SMILES notation for 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide?
The canonical SMILES for 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide is Cc1cc2cc(C(N)=O)ccc2n(-c2ccccc2)c1=O.
What is the InChIKey of 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide?
The InChIKey is XIWVKFNKBKTJFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c1-11-9-13-10-12(16(18)20)7-8-15(13)19(17(11)21)14-5-3-2-4-6-14/h2-10H,1H3,(H2,18,20).
What are the key properties of 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide?
3-methyl-2-oxo-1-phenylquinoline-6-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-oxo-1-phenylquinoline-6-carboxamide is sourced from PubChem (CID 174975874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).