N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide

C24H24N2O2 — CID 6109947

IUPACN-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide
SMILESO=C(N/N=C(\c1ccccc1)C1CCCCC1)c1cc2ccccc2cc1O
InChIInChI=1S/C24H24N2O2/c27-22-16-20-14-8-7-13-19(20)15-21(22)24(28)26-25-23(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1,3-4,7-10,13-16,18,27H,2,5-6,11-12H2,(H,26,28)/b25-23+
InChIKeyHPPVJFODKDBOJX-WJTDDFOZSA-N
MW372.47 g/mol
LogP5.26
Rot. Bonds4

About N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide

N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide (PubChem CID 6109947) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide
PubChem CID6109947
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC NameN-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide
SMILESO=C(N/N=C(\c1ccccc1)C1CCCCC1)c1cc2ccccc2cc1O
InChIInChI=1S/C24H24N2O2/c27-22-16-20-14-8-7-13-19(20)15-21(22)24(28)26-25-23(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1,3-4,7-10,13-16,18,27H,2,5-6,11-12H2,(H,26,28)/b25-23+
InChIKeyHPPVJFODKDBOJX-WJTDDFOZSA-N
XLogP5.26
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 55.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_acyl_naphthol(22)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[[cyclohexyl(phenyl)methylidene]amino]-2-hydroxybenzamide
CID 3970319
N-(1,2-diphenylethylideneamino)-3-hydroxynaphthalene-2-carboxamide
CID 141213886
3-hydroxy-N-(1-naphthalen-2-ylethylideneamino)naphthalene-2-carboxamide
CID 4655754
[(E)-[cyclobutyl(phenyl)methylidene]amino]urea
CID 5381908
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-3-hydroxynaphthalene-2-carboxamide
CID 55690810
N-[bis(4-methoxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide
CID 71673973
(2E)-2-[(3-hydroxynaphthalene-2-carbonyl)hydrazinylidene]pentanedioic acid
CID 7789595
3-hydroxy-N-(1-pyridin-3-ylethylideneamino)naphthalene-2-carboxamide
CID 771599
N-(benzylideneamino)-3-hydroxynaphthalene-2-carboxamide
CID 689876
3-hydroxy-N-(1-naphthalen-1-ylethylideneamino)naphthalene-2-carboxamide
CID 4313343
2-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamoyl]benzoic acid
CID 969323
3-hydroxy-N-[(4-piperidin-1-ylphenyl)methylideneamino]naphthalene-2-carboxamide
CID 4045679

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide (CID 6109947) is N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide is O=C(N/N=C(\c1ccccc1)C1CCCCC1)c1cc2ccccc2cc1O.
What is the InChIKey of N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide?
The InChIKey is HPPVJFODKDBOJX-WJTDDFOZSA-N. The full InChI is InChI=1S/C24H24N2O2/c27-22-16-20-14-8-7-13-19(20)15-21(22)24(28)26-25-23(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1,3-4,7-10,13-16,18,27H,2,5-6,11-12H2,(H,26,28)/b25-23+.
What are the key properties of N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide?
N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide has a molecular weight of 372.47 g/mol, XLogP of 5.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-[cyclohexyl(phenyl)methylidene]amino]-3-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 6109947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).