N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide

C22H15ClN2O2 — CID 1310618

IUPACN-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C22H15ClN2O2/c23-15-10-11-21(26)20(12-15)25-22(27)17-13-19(14-6-2-1-3-7-14)24-18-9-5-4-8-16(17)18/h1-13,26H,(H,25,27)
InChIKeyKWTOXQCCTGQDTA-UHFFFAOYSA-N
MW374.83 g/mol
LogP5.51
Rot. Bonds3

About N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide

N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide (PubChem CID 1310618) has the molecular formula C22H15ClN2O2 and a molecular weight of 374.83 g/mol. Its IUPAC name is N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide
PubChem CID1310618
Molecular FormulaC22H15ClN2O2
Molecular Weight374.83 g/mol
Exact Mass374.08
IUPAC NameN-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1O)c1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C22H15ClN2O2/c23-15-10-11-21(26)20(12-15)25-22(27)17-13-19(14-6-2-1-3-7-14)24-18-9-5-4-8-16(17)18/h1-13,26H,(H,25,27)
InChIKeyKWTOXQCCTGQDTA-UHFFFAOYSA-N
XLogP5.51
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.83
LogP ≤ 55.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-chloro-2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 2923025
N-(4-chloro-2-methylphenyl)-2-(4-chlorophenyl)quinoline-4-carboxamide
CID 7914734
N-(2,4-dichlorophenyl)-2-(3,4-dichlorophenyl)quinoline-4-carboxamide
CID 3264826
N-(4-chloro-2-fluorophenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 4196964
N-(2-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39889991
N-(2,6-dichlorophenyl)-2-phenylquinoline-4-carboxamide
CID 2259441
5-chloro-2-hydroxy-N-[(1S)-1-phenylethyl]benzamide;2-phenyl-N-[(1S)-1-phenylethyl]quinoline-4-carboxamide
CID 159321115
2-(4-chlorophenyl)-N-(2,4-difluorophenyl)quinoline-4-carboxamide
CID 2165659
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
2-(4-chlorophenyl)-N-(4-phenyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 2163412
N-(4-chlorophenyl)-2-(4-fluorophenyl)quinoline-4-carboxamide
CID 3131336
N-(2-chlorophenyl)-2-(2,4-dichlorophenyl)quinoline-4-carboxamide
CID 3131012

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide?
The IUPAC name of N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide (CID 1310618) is N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide?
The canonical SMILES for N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide is O=C(Nc1cc(Cl)ccc1O)c1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide?
The InChIKey is KWTOXQCCTGQDTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15ClN2O2/c23-15-10-11-21(26)20(12-15)25-22(27)17-13-19(14-6-2-1-3-7-14)24-18-9-5-4-8-16(17)18/h1-13,26H,(H,25,27).
What are the key properties of N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide?
N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide has a molecular weight of 374.83 g/mol, XLogP of 5.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-hydroxyphenyl)-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 1310618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).