N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide

C19H17NO2 — CID 74080585

IUPACN-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide
SMILESO=C(NCc1ccccc1)C(O)c1cccc2ccccc12
InChIInChI=1S/C19H17NO2/c21-18(19(22)20-13-14-7-2-1-3-8-14)17-12-6-10-15-9-4-5-11-16(15)17/h1-12,18,21H,13H2,(H,20,22)
InChIKeyXTDOKNYPYNKTML-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.19
Rot. Bonds4

About N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide

N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide (PubChem CID 74080585) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide
PubChem CID74080585
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC NameN-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide
SMILESO=C(NCc1ccccc1)C(O)c1cccc2ccccc12
InChIInChI=1S/C19H17NO2/c21-18(19(22)20-13-14-7-2-1-3-8-14)17-12-6-10-15-9-4-5-11-16(15)17/h1-12,18,21H,13H2,(H,20,22)
InChIKeyXTDOKNYPYNKTML-UHFFFAOYSA-N
XLogP3.19
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide 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

4-[2-(Hydroxymethyl)naphthalen-1-Yl]-N-[2-(Morpholin-4-Yl)ethyl]benzamide
CID 60196237
(2S,3R)-3-Amino-4-cyclohexyl-2-hydroxy-N-naphthalen-2-ylmethyl-butyramide
CID 44381636
(2S,3R)-3-Amino-4-cyclohexyl-2-hydroxy-N-(1-naphthalen-2-yl-ethyl)-butyramide
CID 44381648
(2S,3R)-3-amino-2-hydroxy-N-methyl-N-(naphthalen-1-ylmethyl)-5-phenylpentanamide
CID 44381955
(2S,3R)-3-amino-2-hydroxy-N-[(1S)-1-naphthalen-1-ylethyl]-5-phenylpentanamide
CID 44381987
(R)-3-Amino-3-cyclohexyl-2-hydroxy-N-((S)-1-naphthalen-1-yl-ethyl)-propionamide
CID 44382074
(2S,3R)-3-Amino-4-cyclohexyl-2-hydroxy-N-methyl-N-naphthalen-1-ylmethyl-butyramide
CID 44382396
(2R)-N-[(1S)-3-(dimethylamino)-1-naphthalen-2-ylpropyl]-2-methoxy-2-phenylacetamide;hydrochloride
CID 45481580
2,6-difluoro-N-[2-hydroxy-2-(2-naphthyl)ethyl]benzenecarboxamide
CID 3544778
N-Benzyl-2-hydroxy-2-phenylacetamide
CID 222718
N-[(2S,3R)-3-hydroxy-1-phenyl-4-(2-phenylpropan-2-ylamino)butan-2-yl]-2-naphthalen-1-ylacetamide
CID 71717628
N-(3,3-diphenylpropyl)-2-hydroxy-2-phenylheptanamide
CID 11154247

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide?
The IUPAC name of N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide (CID 74080585) is N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide is O=C(NCc1ccccc1)C(O)c1cccc2ccccc12.
What is the InChIKey of N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide?
The InChIKey is XTDOKNYPYNKTML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c21-18(19(22)20-13-14-7-2-1-3-8-14)17-12-6-10-15-9-4-5-11-16(15)17/h1-12,18,21H,13H2,(H,20,22).
What are the key properties of N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide?
N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide has a molecular weight of 291.35 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-hydroxy-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 74080585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).