N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide

C13H19NO2 — CID 62335120

IUPACN-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide
SMILESCC(O)CN(C)C(=O)CCc1ccccc1
InChIInChI=1S/C13H19NO2/c1-11(15)10-14(2)13(16)9-8-12-6-4-3-5-7-12/h3-7,11,15H,8-10H2,1-2H3
InChIKeyZLIKTDDIFSAFHF-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.46
Rot. Bonds5

About N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide

N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide (PubChem CID 62335120) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide
PubChem CID62335120
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide
SMILESCC(O)CN(C)C(=O)CCc1ccccc1
InChIInChI=1S/C13H19NO2/c1-11(15)10-14(2)13(16)9-8-12-6-4-3-5-7-12/h3-7,11,15H,8-10H2,1-2H3
InChIKeyZLIKTDDIFSAFHF-UHFFFAOYSA-N
XLogP1.46
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide?
The IUPAC name of N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide (CID 62335120) is N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide.
What is the SMILES notation for N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide?
The canonical SMILES for N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide is CC(O)CN(C)C(=O)CCc1ccccc1.
What is the InChIKey of N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide?
The InChIKey is ZLIKTDDIFSAFHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-11(15)10-14(2)13(16)9-8-12-6-4-3-5-7-12/h3-7,11,15H,8-10H2,1-2H3.
What are the key properties of N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide?
N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide has a molecular weight of 221.30 g/mol, XLogP of 1.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-N-methyl-3-phenylpropanamide is sourced from PubChem (CID 62335120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).