N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide

C11H15NO2 — CID 95367778

IUPACN-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
SMILESCC(=O)NC[C@@H](O)Cc1ccccc1
InChIInChI=1S/C11H15NO2/c1-9(13)12-8-11(14)7-10-5-3-2-4-6-10/h2-6,11,14H,7-8H2,1H3,(H,12,13)/t11-/m0/s1
InChIKeyGTYZRIDUNYQIFH-NSHDSACASA-N
MW193.25 g/mol
LogP0.73
Rot. Bonds4

About N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide

N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide (PubChem CID 95367778) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide.

Molecular Properties

Compound NameN-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
PubChem CID95367778
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC NameN-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
SMILESCC(=O)NC[C@@H](O)Cc1ccccc1
InChIInChI=1S/C11H15NO2/c1-9(13)12-8-11(14)7-10-5-3-2-4-6-10/h2-6,11,14H,7-8H2,1H3,(H,12,13)/t11-/m0/s1
InChIKeyGTYZRIDUNYQIFH-NSHDSACASA-N
XLogP0.73
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide 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

1-(2-ethylbutyl)-3-(2-hydroxy-3-phenylpropyl)urea
CID 111102261
N-(2-hydroxy-3-phenylpropyl)-3-methyl-2-phenylbutanamide
CID 111477366
2-(diethylamino)-N-(2-hydroxy-3-phenylpropyl)acetamide
CID 111102671
N-(2-hydroxy-3-phenylpropyl)hexanamide
CID 111102787
N'-(4-ethylphenyl)-N-(2-hydroxy-3-phenylpropyl)oxamide
CID 90534548
1-(2-hydroxy-3-phenylpropyl)-3-phenylmethoxyurea
CID 110937017
2-bromo-N-(2-hydroxy-3-phenylpropyl)benzamide
CID 56765281
1-(2-hydroxy-3-phenylpropyl)-3-(3-methylsulfanylpropyl)urea
CID 111434483
1-(2-ethoxyethyl)-3-(2-hydroxy-3-phenylpropyl)urea
CID 110937061
N-(2-hydroxy-3-phenylpropyl)-3,5-dimethoxybenzamide
CID 56765275
4-[(2-hydroxy-3-phenylpropyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120673460
2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
CID 95367827

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
The IUPAC name of N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide (CID 95367778) is N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide.
What is the SMILES notation for N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
The canonical SMILES for N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide is CC(=O)NC[C@@H](O)Cc1ccccc1.
What is the InChIKey of N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
The InChIKey is GTYZRIDUNYQIFH-NSHDSACASA-N. The full InChI is InChI=1S/C11H15NO2/c1-9(13)12-8-11(14)7-10-5-3-2-4-6-10/h2-6,11,14H,7-8H2,1H3,(H,12,13)/t11-/m0/s1.
What are the key properties of N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide has a molecular weight of 193.25 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide is sourced from PubChem (CID 95367778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).