N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide

C19H16N2O2 — CID 135684568

IUPACN-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide
SMILESC/C(=N\NC(=O)c1cccc2ccccc12)c1ccccc1O
InChIInChI=1S/C19H16N2O2/c1-13(15-9-4-5-12-18(15)22)20-21-19(23)17-11-6-8-14-7-2-3-10-16(14)17/h2-12,22H,1H3,(H,21,23)/b20-13+
InChIKeyXTDPXEKJVVKHKB-DEDYPNTBSA-N
MW304.35 g/mol
LogP3.70
Rot. Bonds3

About N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide

N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide (PubChem CID 135684568) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide
PubChem CID135684568
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC NameN-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide
SMILESC/C(=N\NC(=O)c1cccc2ccccc12)c1ccccc1O
InChIInChI=1S/C19H16N2O2/c1-13(15-9-4-5-12-18(15)22)20-21-19(23)17-11-6-8-14-7-2-3-10-16(14)17/h2-12,22H,1H3,(H,21,23)/b20-13+
InChIKeyXTDPXEKJVVKHKB-DEDYPNTBSA-N
XLogP3.70
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', '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

4-(4-hydroxy-3,5-dimethylphenyl)-2-methylphthalazin-1(2H)-one
CID 624420
N'-cyclohexylidene-3-hydroxynaphthalene-2-carbohydrazide
CID 795531
N'-(2-hydroxybenzoyl)naphthalene-1-carbohydrazide
CID 22613412
2-Hydroxy-1-naphthalaldehyde salicyloylhydrazone
CID 135458654
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'-bicyclo[2.2.1]hept-2-ylidene-3-hydroxy-2-naphthohydrazide
CID 9670172
N-[(E)-(5,7-dimethyl-3,4-dihydro-2H-naphthalen-1-ylidene)amino]-4-hydroxybenzamide
CID 9684188
4-hydroxy-N'-[(2-hydroxy-1-naphthyl)methylene]benzohydrazide
CID 135400287
Naphthalene-1-carboxylic acid (2-hydroxy-benzylidene)-hydrazide
CID 135400487

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide?
The IUPAC name of N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide (CID 135684568) is N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide.
What is the SMILES notation for N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide?
The canonical SMILES for N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide is C/C(=N\NC(=O)c1cccc2ccccc12)c1ccccc1O.
What is the InChIKey of N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide?
The InChIKey is XTDPXEKJVVKHKB-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-13(15-9-4-5-12-18(15)22)20-21-19(23)17-11-6-8-14-7-2-3-10-16(14)17/h2-12,22H,1H3,(H,21,23)/b20-13+.
What are the key properties of N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide?
N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 3.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]naphthalene-1-carboxamide is sourced from PubChem (CID 135684568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).