N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide

C19H16N2O3 — CID 4164317

IUPACN-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NN=Cc1ccc2ccccc2c1O
InChIInChI=1S/C19H16N2O3/c22-18(13-24-16-7-2-1-3-8-16)21-20-12-15-11-10-14-6-4-5-9-17(14)19(15)23/h1-12,23H,13H2,(H,21,22)
InChIKeyXAFGRYRNUCSDTM-UHFFFAOYSA-N
MW320.35 g/mol
LogP3.07
Rot. Bonds5

About N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide

N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide (PubChem CID 4164317) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide
PubChem CID4164317
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC NameN-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NN=Cc1ccc2ccccc2c1O
InChIInChI=1S/C19H16N2O3/c22-18(13-24-16-7-2-1-3-8-16)21-20-12-15-11-10-14-6-4-5-9-17(14)19(15)23/h1-12,23H,13H2,(H,21,22)
InChIKeyXAFGRYRNUCSDTM-UHFFFAOYSA-N
XLogP3.07
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'}

Analyze N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide 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

N,N'-bis[(1-hydroxynaphthalen-2-yl)methylideneamino]pentanediamide
CID 4547663
2-naphthalen-2-yloxy-N-[(E)-(2,3,4-trihydroxyphenyl)methylideneamino]acetamide
CID 171978736
N-[(E)-(1-hydroxynaphthalen-2-yl)methylideneamino]-3-phenylpropanamide
CID 135605985
N-[(Z)-(2-bromophenyl)methylideneamino]-2-phenoxyacetamide
CID 5414432
N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-3-methylbutanamide
CID 5177464
N-[(E)-(1-hydroxynaphthalen-2-yl)methylideneamino]-3-methylbutanamide
CID 135752096
2-(4-fluorophenoxy)-N-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]acetamide
CID 137054697
N-[(Z)-(2-hydroxy-4-propan-2-yloxyphenyl)methylideneamino]-2-phenoxyacetamide
CID 137074822
N-(naphthalen-1-ylmethylideneamino)-2-(4-propan-2-ylphenoxy)acetamide
CID 927198
2-N,5-N-bis[(E)-(1-hydroxynaphthalen-2-yl)methylideneamino]furan-2,5-dicarboxamide
CID 135837519
2-N,5-N-bis[(1-hydroxynaphthalen-2-yl)methylideneamino]furan-2,5-dicarboxamide
CID 4670148
N-[(2-hydroxy-3-methoxyphenyl)methylideneamino]-2-naphthalen-2-yloxyacetamide
CID 3762152

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide?
The IUPAC name of N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide (CID 4164317) is N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide.
What is the SMILES notation for N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide?
The canonical SMILES for N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide is O=C(COc1ccccc1)NN=Cc1ccc2ccccc2c1O.
What is the InChIKey of N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide?
The InChIKey is XAFGRYRNUCSDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3/c22-18(13-24-16-7-2-1-3-8-16)21-20-12-15-11-10-14-6-4-5-9-17(14)19(15)23/h1-12,23H,13H2,(H,21,22).
What are the key properties of N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide?
N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide has a molecular weight of 320.35 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxynaphthalen-2-yl)methylideneamino]-2-phenoxyacetamide is sourced from PubChem (CID 4164317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).