N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide

C19H23NO2 — CID 11748505

IUPACN-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide
SMILESCCCC(=O)N(Cc1ccccc1)[C@@H](CO)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-2-9-19(22)20(14-16-10-5-3-6-11-16)18(15-21)17-12-7-4-8-13-17/h3-8,10-13,18,21H,2,9,14-15H2,1H3/t18-/m0/s1
InChIKeyFICAAJXROWNDCQ-SFHVURJKSA-N
MW297.40 g/mol
LogP3.55
Rot. Bonds7

About N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide

N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide (PubChem CID 11748505) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide.

Molecular Properties

Compound NameN-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide
PubChem CID11748505
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide
SMILESCCCC(=O)N(Cc1ccccc1)[C@@H](CO)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-2-9-19(22)20(14-16-10-5-3-6-11-16)18(15-21)17-12-7-4-8-13-17/h3-8,10-13,18,21H,2,9,14-15H2,1H3/t18-/m0/s1
InChIKeyFICAAJXROWNDCQ-SFHVURJKSA-N
XLogP3.55
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide 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-benzyl-N-butan-2-ylbutanamide
CID 60717440
CID 136872538
CID 136872538
(3S)-N-benzyl-3-diethoxyphosphoryl-N-[(1R)-2-hydroxy-1-phenylethyl]-4-methylpentanamide
CID 101089814
(E)-N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]-4-methylpent-2-enamide
CID 101089812
N-benzyl-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
CID 132649959
2-[benzyl(butanoyl)amino]-N-butylbutanamide
CID 132699427
N-benzyl-N-butan-2-ylpentanamide
CID 78842113
N-benzyl-N-[(2S)-1-(2-methylpropylamino)-1-oxo-3-phenylpropan-2-yl]butanamide
CID 100741860
N-[(4-methoxyphenyl)methyl]-N-[2-oxo-1-phenyl-2-(2-phenylethylamino)ethyl]butanamide
CID 133238726
(2R)-2-[amino(benzyl)amino]-2-phenylethanol
CID 15856855
N-benzyl-4-methyl-N-propan-2-ylpentanamide
CID 86978961
benzyl 2-[benzyl(octanoyl)amino]-2-phenylacetate
CID 135023630

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide?
The IUPAC name of N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide (CID 11748505) is N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide.
What is the SMILES notation for N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide?
The canonical SMILES for N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide is CCCC(=O)N(Cc1ccccc1)[C@@H](CO)c1ccccc1.
What is the InChIKey of N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide?
The InChIKey is FICAAJXROWNDCQ-SFHVURJKSA-N. The full InChI is InChI=1S/C19H23NO2/c1-2-9-19(22)20(14-16-10-5-3-6-11-16)18(15-21)17-12-7-4-8-13-17/h3-8,10-13,18,21H,2,9,14-15H2,1H3/t18-/m0/s1.
What are the key properties of N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide?
N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide has a molecular weight of 297.40 g/mol, XLogP of 3.55, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide is sourced from PubChem (CID 11748505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).