3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide

C14H21NO3 — CID 107861315

IUPAC3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide
SMILESCCOCCC(=O)N[C@@H](CO)Cc1ccccc1
InChIInChI=1S/C14H21NO3/c1-2-18-9-8-14(17)15-13(11-16)10-12-6-4-3-5-7-12/h3-7,13,16H,2,8-11H2,1H3,(H,15,17)/t13-/m1/s1
InChIKeyUXAGFSCKAFYADL-CYBMUJFWSA-N
MW251.33 g/mol
LogP1.13
Rot. Bonds8

About 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide

3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide (PubChem CID 107861315) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide.

Molecular Properties

Compound Name3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide
PubChem CID107861315
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide
SMILESCCOCCC(=O)N[C@@H](CO)Cc1ccccc1
InChIInChI=1S/C14H21NO3/c1-2-18-9-8-14(17)15-13(11-16)10-12-6-4-3-5-7-12/h3-7,13,16H,2,8-11H2,1H3,(H,15,17)/t13-/m1/s1
InChIKeyUXAGFSCKAFYADL-CYBMUJFWSA-N
XLogP1.13
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide 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,N'-bis[(2S)-1-hydroxy-3-phenylpropan-2-yl]butanediamide
CID 102096047
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]octanamide
CID 102673841
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]heptanamide
CID 42364081
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]hexadecanamide
CID 15667273
2-methoxyethyl 4-[(1-hydroxy-3-phenylpropan-2-yl)amino]-4-oxobutanoate
CID 156622371
3-(dimethylamino)-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide
CID 107861208
5-amino-N-(1-hydroxy-3-phenylpropan-2-yl)hexanamide
CID 82851763
5-amino-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]hexanamide
CID 107860949
2-(2-ethoxyethylamino)-3-phenylpropan-1-ol
CID 63261508
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-methoxyacetamide
CID 101173549
3-acetamido-N-(1-hydroxy-3-phenylpropan-2-yl)propanamide
CID 63260698
3-ethoxy-N-[(2R)-4-phenylbutan-2-yl]propanamide
CID 7372940

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
The IUPAC name of 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide (CID 107861315) is 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide.
What is the SMILES notation for 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
The canonical SMILES for 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide is CCOCCC(=O)N[C@@H](CO)Cc1ccccc1.
What is the InChIKey of 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
The InChIKey is UXAGFSCKAFYADL-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H21NO3/c1-2-18-9-8-14(17)15-13(11-16)10-12-6-4-3-5-7-12/h3-7,13,16H,2,8-11H2,1H3,(H,15,17)/t13-/m1/s1.
What are the key properties of 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide?
3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide has a molecular weight of 251.33 g/mol, XLogP of 1.13, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide is sourced from PubChem (CID 107861315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).