N-(4-hydroxyphenyl)quinoline-3-carboxamide

C16H12N2O2 — CID 110489513

IUPACN-(4-hydroxyphenyl)quinoline-3-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1cnc2ccccc2c1
InChIInChI=1S/C16H12N2O2/c19-14-7-5-13(6-8-14)18-16(20)12-9-11-3-1-2-4-15(11)17-10-12/h1-10,19H,(H,18,20)
InChIKeyARPGOTMCODLQFV-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.19
Rot. Bonds2

About N-(4-hydroxyphenyl)quinoline-3-carboxamide

N-(4-hydroxyphenyl)quinoline-3-carboxamide (PubChem CID 110489513) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)quinoline-3-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)quinoline-3-carboxamide
PubChem CID110489513
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC NameN-(4-hydroxyphenyl)quinoline-3-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1cnc2ccccc2c1
InChIInChI=1S/C16H12N2O2/c19-14-7-5-13(6-8-14)18-16(20)12-9-11-3-1-2-4-15(11)17-10-12/h1-10,19H,(H,18,20)
InChIKeyARPGOTMCODLQFV-UHFFFAOYSA-N
XLogP3.19
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(quinoline-3-carbonylamino)phenyl]quinoline-3-carboxamide
CID 171577203
N-(3-acetylphenyl)quinoline-3-carboxamide
CID 110694820
N-quinoxalin-2-ylquinoline-3-carboxamide
CID 11522282
N-(2-iodophenyl)quinoline-3-carboxamide
CID 139568501
N-(2-methylsulfonyl-4-pyridinyl)quinoline-3-carboxamide
CID 175916603
6-chloro-N-quinolin-3-ylpyridine-3-carboxamide
CID 29330391
4-methyl-N-quinolin-3-ylbenzamide
CID 974969
4-bromo-N-quinolin-3-ylbenzamide
CID 3301629
N-(4-tert-butylphenyl)-4-quinolin-3-ylbenzamide
CID 58639670
6-(methylamino)-N-quinolin-3-ylpyridine-3-carboxamide
CID 62808644
quinoline-3-carboxylate
CID 4608508
3-chloro-N-quinolin-3-ylbenzamide
CID 3284385

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)quinoline-3-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)quinoline-3-carboxamide (CID 110489513) is N-(4-hydroxyphenyl)quinoline-3-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)quinoline-3-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)quinoline-3-carboxamide is O=C(Nc1ccc(O)cc1)c1cnc2ccccc2c1.
What is the InChIKey of N-(4-hydroxyphenyl)quinoline-3-carboxamide?
The InChIKey is ARPGOTMCODLQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c19-14-7-5-13(6-8-14)18-16(20)12-9-11-3-1-2-4-15(11)17-10-12/h1-10,19H,(H,18,20).
What are the key properties of N-(4-hydroxyphenyl)quinoline-3-carboxamide?
N-(4-hydroxyphenyl)quinoline-3-carboxamide has a molecular weight of 264.28 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)quinoline-3-carboxamide is sourced from PubChem (CID 110489513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).