N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide

C17H18N2O2 — CID 795531

IUPACN-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide
SMILESO=C(NN=C1CCCCC1)c1cc2ccccc2cc1O
InChIInChI=1S/C17H18N2O2/c20-16-11-13-7-5-4-6-12(13)10-15(16)17(21)19-18-14-8-2-1-3-9-14/h4-7,10-11,20H,1-3,8-9H2,(H,19,21)
InChIKeyHEDXCCXRAATJCX-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.60
Rot. Bonds2

About N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide

N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide (PubChem CID 795531) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide
PubChem CID795531
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide
SMILESO=C(NN=C1CCCCC1)c1cc2ccccc2cc1O
InChIInChI=1S/C17H18N2O2/c20-16-11-13-7-5-4-6-12(13)10-15(16)17(21)19-18-14-8-2-1-3-9-14/h4-7,10-11,20H,1-3,8-9H2,(H,19,21)
InChIKeyHEDXCCXRAATJCX-UHFFFAOYSA-N
XLogP3.60
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.60
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'}

Analyze N-(cyclohexylideneamino)-3-hydroxynaphthalene-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

Related Compounds

3-Hydroxy-2-naphthoic acid hydrazide
CID 72699
Dynasore
CID 135533054
1-hydroxy-N'-(4-methoxybenzoyl)-2-naphthohydrazide
CID 774191
N'-(2-hydroxybenzoyl)naphthalene-1-carbohydrazide
CID 22613412
2-Hydroxy-1-naphthalaldehyde salicyloylhydrazone
CID 135458654
3-Hydroxy-2-naphthalenecarboxamide
CID 19317
4-Methylbenzoic (2-hydroxy-1-naphthylmethylene)hydrazide
CID 135407190
N'-(1,3-dimethylbutylidene)-3-hydroxy-2-naphthohydrazide
CID 5779530
N'-cycloheptylidene-3-hydroxynaphthalene-2-carbohydrazide
CID 3623129
N'-[(1Z)-1-(3-hydroxyphenyl)ethylidene]biphenyl-4-carbohydrazide
CID 6081739
N-[[3-(4-formylpiperazino)-3-keto-1-methyl-propylidene]amino]-3-hydroxy-2-naphthamide
CID 9591949
N'-bicyclo[2.2.1]hept-2-ylidene-3-hydroxy-2-naphthohydrazide
CID 9670172

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide (CID 795531) is N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide is O=C(NN=C1CCCCC1)c1cc2ccccc2cc1O.
What is the InChIKey of N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide?
The InChIKey is HEDXCCXRAATJCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c20-16-11-13-7-5-4-6-12(13)10-15(16)17(21)19-18-14-8-2-1-3-9-14/h4-7,10-11,20H,1-3,8-9H2,(H,19,21).
What are the key properties of N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide?
N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 3.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylideneamino)-3-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 795531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).