N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide

C19H16N2O2 — CID 796792

IUPACN-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O2/c1-13(22)21-16-9-7-15(8-10-16)20-12-18-17-5-3-2-4-14(17)6-11-19(18)23/h2-12,23H,1H3,(H,21,22)/b20-12+
InChIKeyBWGKTGISDMYZSF-UDWIEESQSA-N
MW304.35 g/mol
LogP4.25
Rot. Bonds3

About N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide

N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide (PubChem CID 796792) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide
PubChem CID796792
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC NameN-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O2/c1-13(22)21-16-9-7-15(8-10-16)20-12-18-17-5-3-2-4-14(17)6-11-19(18)23/h2-12,23H,1H3,(H,21,22)/b20-12+
InChIKeyBWGKTGISDMYZSF-UDWIEESQSA-N
XLogP4.25
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 ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(4-Hydroxyphenyliminomethyl)-2-naphthol
CID 269970
N-(3-((2-hydroxynaphthalen-1-ylmethylene)amino)phenyl)-2-phenylpropionamide
CID 135659046
1-(Anilinomethylidene)-2-naphthalenone
CID 269969
Meta-sirtinol
CID 135461039
Para-sirtinol
CID 135491748
N-(2-ethylphenyl)-2-[(2-hydroxynaphthalen-1-yl)methyl-methylamino]acetamide
CID 2496326
1-{(E)-[(4-vinylphenyl)imino]methyl}-2-naphthol
CID 4445693
2-[(2-hydroxynaphthalen-1-yl)methyl-methylamino]-N-(4-methylphenyl)acetamide
CID 7997911
2-anilino-N'-[(1E)-(2-hydroxy-1-naphthyl)methylene]acetohydrazide
CID 135699116
2-[(4-Fluorophenyl)amino]-N'-[(E)-(2-hydroxynaphthalen-1-YL)methylidene]acetohydrazide
CID 135745098
1-[(Phenylamino)methyl]naphthalen-2-ol
CID 241245
N-(3-(2-Hydroxy-6-(3-hydroxyphenyl)naphthalene-1-yl)phenyl)acetamide
CID 25069767

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide?
The IUPAC name of N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide (CID 796792) is N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide is CC(=O)Nc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1.
What is the InChIKey of N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide?
The InChIKey is BWGKTGISDMYZSF-UDWIEESQSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-13(22)21-16-9-7-15(8-10-16)20-12-18-17-5-3-2-4-14(17)6-11-19(18)23/h2-12,23H,1H3,(H,21,22)/b20-12+.
What are the key properties of N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide?
N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide has a molecular weight of 304.35 g/mol, XLogP of 4.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-hydroxynaphthalen-1-yl)methylideneamino]phenyl]acetamide is sourced from PubChem (CID 796792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).