2-phenylquinoline-3-carboxamide

C16H12N2O — CID 22159420

IUPAC2-phenylquinoline-3-carboxamide
SMILESNC(=O)c1cc2ccccc2nc1-c1ccccc1
InChIInChI=1S/C16H12N2O/c17-16(19)13-10-12-8-4-5-9-14(12)18-15(13)11-6-2-1-3-7-11/h1-10H,(H2,17,19)
InChIKeyVHVLFCBCBAVXQR-UHFFFAOYSA-N
MW248.29 g/mol
LogP3.00
Rot. Bonds2

About 2-phenylquinoline-3-carboxamide

2-phenylquinoline-3-carboxamide (PubChem CID 22159420) has the molecular formula C16H12N2O and a molecular weight of 248.29 g/mol. Its IUPAC name is 2-phenylquinoline-3-carboxamide.

Molecular Properties

Compound Name2-phenylquinoline-3-carboxamide
PubChem CID22159420
Molecular FormulaC16H12N2O
Molecular Weight248.29 g/mol
Exact Mass248.09
IUPAC Name2-phenylquinoline-3-carboxamide
SMILESNC(=O)c1cc2ccccc2nc1-c1ccccc1
InChIInChI=1S/C16H12N2O/c17-16(19)13-10-12-8-4-5-9-14(12)18-15(13)11-6-2-1-3-7-11/h1-10H,(H2,17,19)
InChIKeyVHVLFCBCBAVXQR-UHFFFAOYSA-N
XLogP3.00
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-chloroquinolin-2-yl)benzamide
CID 164550210
furan-2-yl-(2-phenylquinolin-3-yl)methanone
CID 164676438
acridine-4-carboxamide
CID 3025721
(4-nitrophenyl)-(2-phenylquinolin-3-yl)methanone
CID 137346253
7-[(3-chloropyrazin-2-yl)methyl]-2-phenylquinoline-3-carboxamide
CID 173087421
2-(4-acetyloxyphenyl)quinoline-3-carboxylic acid
CID 67205702
acridine-1,2-dicarboxamide
CID 154155519
3-amino-2-phenylquinoline-4-carboxamide
CID 140977990
2,3-diphenylquinoline-8-carboxamide
CID 174821968
CID 70080980
CID 70080980
2-amino-4-quinolin-3-ylpyrimidine-5-carboxamide
CID 118961864
2-phenyl-3-(2-phenylquinolin-3-yl)oxyquinoline
CID 175690294

Frequently Asked Questions

What is the IUPAC name of 2-phenylquinoline-3-carboxamide?
The IUPAC name of 2-phenylquinoline-3-carboxamide (CID 22159420) is 2-phenylquinoline-3-carboxamide.
What is the SMILES notation for 2-phenylquinoline-3-carboxamide?
The canonical SMILES for 2-phenylquinoline-3-carboxamide is NC(=O)c1cc2ccccc2nc1-c1ccccc1.
What is the InChIKey of 2-phenylquinoline-3-carboxamide?
The InChIKey is VHVLFCBCBAVXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O/c17-16(19)13-10-12-8-4-5-9-14(12)18-15(13)11-6-2-1-3-7-11/h1-10H,(H2,17,19).
What are the key properties of 2-phenylquinoline-3-carboxamide?
2-phenylquinoline-3-carboxamide has a molecular weight of 248.29 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylquinoline-3-carboxamide is sourced from PubChem (CID 22159420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).