N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide

C18H14N2O2 — CID 4115727

IUPACN-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide
SMILESO=C(NN=Cc1ccccc1)c1ccc2ccccc2c1O
InChIInChI=1S/C18H14N2O2/c21-17-15-9-5-4-8-14(15)10-11-16(17)18(22)20-19-12-13-6-2-1-3-7-13/h1-12,21H,(H,20,22)
InChIKeyUULFEIYJHALXPU-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.31
Rot. Bonds3

About N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide

N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide (PubChem CID 4115727) has the molecular formula C18H14N2O2 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide
PubChem CID4115727
Molecular FormulaC18H14N2O2
Molecular Weight290.32 g/mol
Exact Mass290.11
IUPAC NameN-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide
SMILESO=C(NN=Cc1ccccc1)c1ccc2ccccc2c1O
InChIInChI=1S/C18H14N2O2/c21-17-15-9-5-4-8-14(15)10-11-16(17)18(22)20-19-12-13-6-2-1-3-7-13/h1-12,21H,(H,20,22)
InChIKeyUULFEIYJHALXPU-UHFFFAOYSA-N
XLogP3.31
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-(4-fluorophenyl)methylideneamino]-1-hydroxynaphthalene-2-carboxamide
CID 6260271
N-[(Z)-(3-fluorophenyl)methylideneamino]-1-hydroxynaphthalene-2-carboxamide
CID 6019016
1-hydroxy-N-[(Z)-pyridin-3-ylmethylideneamino]naphthalene-2-carboxamide
CID 5412473
N-(anthracen-9-ylmethylideneamino)-1-hydroxynaphthalene-2-carboxamide
CID 3995979
1-hydroxy-N-[(Z)-(4-hydroxy-3-methoxyphenyl)methylideneamino]naphthalene-2-carboxamide
CID 136742494
N-(benzylideneamino)-3-hydroxynaphthalene-2-carboxamide
CID 689876
2-chloro-N-[(Z)-(1-hydroxynaphthalen-2-yl)methylideneamino]benzamide
CID 135782033
N-[(E)-benzylideneamino]-2-(hydroxymethyl)benzamide
CID 138392331
N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-1-hydroxynaphthalene-2-carboxamide
CID 6019936
1-hydroxy-N-[(2,3,4-trimethoxyphenyl)methylideneamino]naphthalene-2-carboxamide
CID 3617184
N-[(4-bromophenyl)methylideneamino]naphthalene-1-carboxamide
CID 1377406
[1-[(E)-[(1-hydroxynaphthalene-2-carbonyl)hydrazinylidene]methyl]naphthalen-2-yl] naphthalene-1-carboxylate
CID 46500871

Frequently Asked Questions

What is the IUPAC name of N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide (CID 4115727) is N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide is O=C(NN=Cc1ccccc1)c1ccc2ccccc2c1O.
What is the InChIKey of N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide?
The InChIKey is UULFEIYJHALXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c21-17-15-9-5-4-8-14(15)10-11-16(17)18(22)20-19-12-13-6-2-1-3-7-13/h1-12,21H,(H,20,22).
What are the key properties of N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide?
N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzylideneamino)-1-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 4115727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).