N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide

C17H17NO3 — CID 71218694

IUPACN-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide
SMILESCC(=O)C(O)C(NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H17NO3/c1-12(19)16(20)15(13-8-4-2-5-9-13)18-17(21)14-10-6-3-7-11-14/h2-11,15-16,20H,1H3,(H,18,21)
InChIKeyFAZNZASJYPCIPM-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.11
Rot. Bonds5

About N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide

N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide (PubChem CID 71218694) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide
PubChem CID71218694
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC NameN-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide
SMILESCC(=O)C(O)C(NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H17NO3/c1-12(19)16(20)15(13-8-4-2-5-9-13)18-17(21)14-10-6-3-7-11-14/h2-11,15-16,20H,1H3,(H,18,21)
InChIKeyFAZNZASJYPCIPM-UHFFFAOYSA-N
XLogP2.11
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide 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

3-benzamido-2-hydroxy-3-phenylpropanoic acid;hydrochloride
CID 175045736
N-[(1R)-2-acetyl-3-oxo-1-phenylbutyl]benzamide
CID 11587624
(2S,3R)-3-benzamido-2-hydroxy-3-phenylpropanethioic S-acid
CID 18660976
N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide
CID 6934600
N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide
CID 134903315
N-(2,3-dihydroxy-1-phenylpropyl)benzamide
CID 14650575
benzyl (2R)-3-benzamido-2-hydroxy-3-phenylpropanoate
CID 102178448
N-[(1S,2R)-2-hydroxy-1-phenylbut-3-enyl]benzamide
CID 57161994
ethyl (2S,3S)-3-benzamido-2-hydroxy-3-(4-methylphenyl)propanoate
CID 163362380
ethyl 2-hydroxy-3-[(4-methylbenzoyl)amino]-3-phenylpropanoate
CID 175230442
methyl (2S,3S)-2-acetyloxy-3-benzamido-3-phenylpropanoate
CID 11110608
ethyl (2S,3S)-3-benzamido-3-(4-fluorophenyl)-2-hydroxypropanoate
CID 163362371

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide?
The IUPAC name of N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide (CID 71218694) is N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide.
What is the SMILES notation for N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide?
The canonical SMILES for N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide is CC(=O)C(O)C(NC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide?
The InChIKey is FAZNZASJYPCIPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-12(19)16(20)15(13-8-4-2-5-9-13)18-17(21)14-10-6-3-7-11-14/h2-11,15-16,20H,1H3,(H,18,21).
What are the key properties of N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide?
N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide has a molecular weight of 283.33 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide is sourced from PubChem (CID 71218694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).