N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide

C21H15N3O2 — CID 39311131

IUPACN-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1cc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C21H15N3O2/c25-16-9-7-15(8-10-16)23-21(26)18-12-20(14-4-3-11-22-13-14)24-19-6-2-1-5-17(18)19/h1-13,25H,(H,23,26)
InChIKeyHNIYLVPNVHOHGV-UHFFFAOYSA-N
MW341.37 g/mol
LogP4.25
Rot. Bonds3

About N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide

N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide (PubChem CID 39311131) has the molecular formula C21H15N3O2 and a molecular weight of 341.37 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
PubChem CID39311131
Molecular FormulaC21H15N3O2
Molecular Weight341.37 g/mol
Exact Mass341.12
IUPAC NameN-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1cc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C21H15N3O2/c25-16-9-7-15(8-10-16)23-21(26)18-12-20(14-4-3-11-22-13-14)24-19-6-2-1-5-17(18)19/h1-13,25H,(H,23,26)
InChIKeyHNIYLVPNVHOHGV-UHFFFAOYSA-N
XLogP4.25
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-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-(2-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39889991
2-pyridin-3-yl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]quinoline-4-carboxamide
CID 46668985
N-[6-(dimethylamino)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 30294376
N-methyl-2-pyridin-3-ylquinoline-4-carboxamide
CID 53007972
N-[4-[2-oxo-2-(propan-2-ylamino)ethyl]phenyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 55619404
N-[4-(cyclopentylcarbamoyl)phenyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 55958082
N-naphthalen-1-yl-2-pyridin-3-ylquinoline-4-carboxamide
CID 25180097
N-(3-fluoro-4-methoxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 55868418
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 56566302
N-(6-piperidin-1-yl-3-pyridinyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 24612164
2-pyridin-3-yl-N-(1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide
CID 29369713
N-[3-(4-hydroxyphenyl)propyl]-2-pyridin-3-ylquinoline-4-carboxamide
CID 86972801

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide (CID 39311131) is N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide is O=C(Nc1ccc(O)cc1)c1cc(-c2cccnc2)nc2ccccc12.
What is the InChIKey of N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide?
The InChIKey is HNIYLVPNVHOHGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3O2/c25-16-9-7-15(8-10-16)23-21(26)18-12-20(14-4-3-11-22-13-14)24-19-6-2-1-5-17(18)19/h1-13,25H,(H,23,26).
What are the key properties of N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide?
N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 4.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide is sourced from PubChem (CID 39311131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).