2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide

C17H28N2O2 — CID 105057950

IUPAC2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NC(C)(CO)c1ccccc1
InChIInChI=1S/C17H28N2O2/c1-5-9-13(2)18-16(21)14(3)19-17(4,12-20)15-10-7-6-8-11-15/h6-8,10-11,13-14,19-20H,5,9,12H2,1-4H3,(H,18,21)
InChIKeyNOMUPTSLHCXIPL-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.18
Rot. Bonds8

About 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide

2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide (PubChem CID 105057950) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide
PubChem CID105057950
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NC(C)(CO)c1ccccc1
InChIInChI=1S/C17H28N2O2/c1-5-9-13(2)18-16(21)14(3)19-17(4,12-20)15-10-7-6-8-11-15/h6-8,10-11,13-14,19-20H,5,9,12H2,1-4H3,(H,18,21)
InChIKeyNOMUPTSLHCXIPL-UHFFFAOYSA-N
XLogP2.18
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide 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

2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentylpropanamide
CID 105057949
ethyl 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]propanoate
CID 105057990
N-cyclopropyl-2-[(1-hydroxy-2-phenylpropan-2-yl)amino]propanamide
CID 105058005
2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-(3-methoxypropyl)propanamide
CID 105058024
2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)pentanamide
CID 105058238
(2S)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)pentanamide
CID 107570839
N-pentan-2-yl-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 78948251
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide
CID 106328554
N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylpentanamide
CID 105058924
2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 105058043
2-(2-methylbutylamino)-2-phenylpropan-1-ol
CID 115687949

Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide?
The IUPAC name of 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide (CID 105057950) is 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)NC(C)(CO)c1ccccc1.
What is the InChIKey of 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide?
The InChIKey is NOMUPTSLHCXIPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-5-9-13(2)18-16(21)14(3)19-17(4,12-20)15-10-7-6-8-11-15/h6-8,10-11,13-14,19-20H,5,9,12H2,1-4H3,(H,18,21).
What are the key properties of 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide?
2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide has a molecular weight of 292.42 g/mol, XLogP of 2.18, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide is sourced from PubChem (CID 105057950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).