N-(4-hydroxyphenyl)naphthalene-2-carboxamide

C17H13NO2 — CID 711475

IUPACN-(4-hydroxyphenyl)naphthalene-2-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C17H13NO2/c19-16-9-7-15(8-10-16)18-17(20)14-6-5-12-3-1-2-4-13(12)11-14/h1-11,19H,(H,18,20)
InChIKeyPKMJWGMXLYXUQF-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.80
Rot. Bonds2

About N-(4-hydroxyphenyl)naphthalene-2-carboxamide

N-(4-hydroxyphenyl)naphthalene-2-carboxamide (PubChem CID 711475) has the molecular formula C17H13NO2 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)naphthalene-2-carboxamide
PubChem CID711475
Molecular FormulaC17H13NO2
Molecular Weight263.30 g/mol
Exact Mass263.09
IUPAC NameN-(4-hydroxyphenyl)naphthalene-2-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C17H13NO2/c19-16-9-7-15(8-10-16)18-17(20)14-6-5-12-3-1-2-4-13(12)11-14/h1-11,19H,(H,18,20)
InChIKeyPKMJWGMXLYXUQF-UHFFFAOYSA-N
XLogP3.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(4-hydroxyphenyl)naphthalene-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)naphthalene-2-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)naphthalene-2-carboxamide (CID 711475) is N-(4-hydroxyphenyl)naphthalene-2-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)naphthalene-2-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)naphthalene-2-carboxamide is O=C(Nc1ccc(O)cc1)c1ccc2ccccc2c1.
What is the InChIKey of N-(4-hydroxyphenyl)naphthalene-2-carboxamide?
The InChIKey is PKMJWGMXLYXUQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO2/c19-16-9-7-15(8-10-16)18-17(20)14-6-5-12-3-1-2-4-13(12)11-14/h1-11,19H,(H,18,20).
What are the key properties of N-(4-hydroxyphenyl)naphthalene-2-carboxamide?
N-(4-hydroxyphenyl)naphthalene-2-carboxamide has a molecular weight of 263.30 g/mol, XLogP of 3.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)naphthalene-2-carboxamide is sourced from PubChem (CID 711475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).