N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide

C15H18N2O3 — CID 97086628

IUPACN-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide
SMILESC[C@@H](O)C[C@H](CNC(=O)c1ccon1)c1ccccc1
InChIInChI=1S/C15H18N2O3/c1-11(18)9-13(12-5-3-2-4-6-12)10-16-15(19)14-7-8-20-17-14/h2-8,11,13,18H,9-10H2,1H3,(H,16,19)/t11-,13-/m1/s1
InChIKeyBBYRRAVGNMODQC-DGCLKSJQSA-N
MW274.32 g/mol
LogP1.96
Rot. Bonds6

About N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide

N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide (PubChem CID 97086628) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide
PubChem CID97086628
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide
SMILESC[C@@H](O)C[C@H](CNC(=O)c1ccon1)c1ccccc1
InChIInChI=1S/C15H18N2O3/c1-11(18)9-13(12-5-3-2-4-6-12)10-16-15(19)14-7-8-20-17-14/h2-8,11,13,18H,9-10H2,1H3,(H,16,19)/t11-,13-/m1/s1
InChIKeyBBYRRAVGNMODQC-DGCLKSJQSA-N
XLogP1.96
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide 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

tert-butyl N-[(2S,4R)-4-hydroxy-2-phenylpentyl]carbamate
CID 97086612
N-(4-hydroxy-2-phenylpentyl)-3-oxocyclobutane-1-carboxamide
CID 110004037
2-chloro-N-(4-hydroxy-2-phenylpentyl)-4,5-dimethylbenzamide
CID 110027851
4-amino-N-(4-hydroxy-2-phenylpentyl)pentanamide
CID 120564094
2-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylpropanamide;hydrochloride
CID 119345419
2-chloro-6-fluoro-N-[(2S,4R)-4-hydroxy-2-phenylpentyl]benzamide
CID 97086616
N-(3-methylbutyl)-1,2-oxazole-3-carboxamide
CID 110693766
N-[(1S)-2-hydroxy-1-phenylethyl]-1,2-oxazole-3-carboxamide
CID 95027054
N-(2-hydroxy-2-thiophen-3-ylethyl)-1,2-oxazole-3-carboxamide
CID 103686497
N-(4-hydroxy-2-phenylpentyl)-4-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 110012995
5-amino-N-(4-hydroxy-2-phenylpentyl)-2-methylbenzamide;hydrochloride
CID 120639082
4-phenylheptane-2,6-diol
CID 173150769

Frequently Asked Questions

What is the IUPAC name of N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide (CID 97086628) is N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide is C[C@@H](O)C[C@H](CNC(=O)c1ccon1)c1ccccc1.
What is the InChIKey of N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide?
The InChIKey is BBYRRAVGNMODQC-DGCLKSJQSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-11(18)9-13(12-5-3-2-4-6-12)10-16-15(19)14-7-8-20-17-14/h2-8,11,13,18H,9-10H2,1H3,(H,16,19)/t11-,13-/m1/s1.
What are the key properties of N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide?
N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 97086628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).