N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide

C23H17NO3 — CID 24949874

IUPACN-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2ccc3cc(O)ccc3c2)cc1O)c1ccccc1
InChIInChI=1S/C23H17NO3/c25-20-10-8-17-12-16(6-7-18(17)13-20)19-9-11-21(22(26)14-19)24-23(27)15-4-2-1-3-5-15/h1-14,25-26H,(H,24,27)
InChIKeyFIHQCUMUTSRFRD-UHFFFAOYSA-N
MW355.39 g/mol
LogP5.17
Rot. Bonds3

About N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide

N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide (PubChem CID 24949874) has the molecular formula C23H17NO3 and a molecular weight of 355.39 g/mol. Its IUPAC name is N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide
PubChem CID24949874
Molecular FormulaC23H17NO3
Molecular Weight355.39 g/mol
Exact Mass355.12
IUPAC NameN-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2ccc3cc(O)ccc3c2)cc1O)c1ccccc1
InChIInChI=1S/C23H17NO3/c25-20-10-8-17-12-16(6-7-18(17)13-20)19-9-11-21(22(26)14-19)24-23(27)15-4-2-1-3-5-15/h1-14,25-26H,(H,24,27)
InChIKeyFIHQCUMUTSRFRD-UHFFFAOYSA-N
XLogP5.17
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.39
LogP ≤ 55.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-dihydroxyphenyl)-4-hydroxybenzamide
CID 171363826
4-amino-N-[4-[4-[(4-aminobenzoyl)amino]-3-hydroxyphenyl]-2-hydroxyphenyl]benzamide
CID 18986447
N-(2,4-dihydroxyphenyl)-4-methoxybenzamide
CID 141075428
N-(1-benzamidoanthracen-2-yl)benzamide
CID 87154988
N-(3-benzamidophenazin-2-yl)benzamide
CID 3547793
N-(4-amino-2,5-dihydroxyphenyl)benzamide
CID 21114775
4-hydroxy-N-(2-hydroxy-4-methylphenyl)benzamide
CID 60654456
N-[4-(cyclohexanecarbonylamino)-2-hydroxyphenyl]benzamide
CID 17363024
N-[2-[(2-hydroxy-4-nitrophenyl)carbamoylamino]phenyl]benzamide
CID 21184645
N-(2,4-dihydroxyphenyl)-2-formylbenzamide
CID 88891446
(4-benzamido-5-hydroxy-2-methylphenyl)azanium
CID 142074982
6-(2-hydroxyphenyl)naphthalen-2-ol
CID 11368353

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide?
The IUPAC name of N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide (CID 24949874) is N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide.
What is the SMILES notation for N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide?
The canonical SMILES for N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide is O=C(Nc1ccc(-c2ccc3cc(O)ccc3c2)cc1O)c1ccccc1.
What is the InChIKey of N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide?
The InChIKey is FIHQCUMUTSRFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO3/c25-20-10-8-17-12-16(6-7-18(17)13-20)19-9-11-21(22(26)14-19)24-23(27)15-4-2-1-3-5-15/h1-14,25-26H,(H,24,27).
What are the key properties of N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide?
N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide has a molecular weight of 355.39 g/mol, XLogP of 5.17, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-4-(6-hydroxynaphthalen-2-yl)phenyl]benzamide is sourced from PubChem (CID 24949874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).