N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide

C11H21NO3 — CID 84578706

IUPACN-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide
SMILESCC(O)CNC(=O)CCC1CCOCC1
InChIInChI=1S/C11H21NO3/c1-9(13)8-12-11(14)3-2-10-4-6-15-7-5-10/h9-10,13H,2-8H2,1H3,(H,12,14)
InChIKeyLGPQWLHLSKGJET-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.69
Rot. Bonds5

About N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide

N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide (PubChem CID 84578706) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide
PubChem CID84578706
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide
SMILESCC(O)CNC(=O)CCC1CCOCC1
InChIInChI=1S/C11H21NO3/c1-9(13)8-12-11(14)3-2-10-4-6-15-7-5-10/h9-10,13H,2-8H2,1H3,(H,12,14)
InChIKeyLGPQWLHLSKGJET-UHFFFAOYSA-N
XLogP0.69
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-hydroxypropyl)-3-(oxan-4-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

3-cyclopentyl-N-(2-methylpropyl)propanamide
CID 918369
N-[(2S)-2-hydroxypropyl]-3-[(2R)-oxolan-2-yl]propanamide
CID 93044550
N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide
CID 83030976
3-cyclopentyl-N-[2-(2-hydroxypropylamino)ethyl]propanamide
CID 104593435
3-cyclohexyl-N-[2-(2-hydroxypropylamino)ethyl]propanamide
CID 104593625
(2S)-4-(oxan-4-yl)butan-2-ol
CID 94422373
(2R)-4-(oxan-4-yl)butan-2-ol
CID 94422374
N-(2-amino-3-hydroxybutyl)-3-cyclohexylpropanamide
CID 64541698
methyl 3-(oxan-4-yl)propanoate
CID 55296577
(2S)-2-[(3-methylphenyl)methyl]-3-[3-(oxan-4-yl)propanoylamino]propanoic acid
CID 97324615
N-[[1-(methylaminomethyl)cyclobutyl]methyl]-3-(oxan-4-yl)propanamide
CID 115272152
3-(oxan-4-yl)-N-(1-phenylethyl)propanamide
CID 84578473

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide?
The IUPAC name of N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide (CID 84578706) is N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide.
What is the SMILES notation for N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide?
The canonical SMILES for N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide is CC(O)CNC(=O)CCC1CCOCC1.
What is the InChIKey of N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide?
The InChIKey is LGPQWLHLSKGJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-9(13)8-12-11(14)3-2-10-4-6-15-7-5-10/h9-10,13H,2-8H2,1H3,(H,12,14).
What are the key properties of N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide?
N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide has a molecular weight of 215.29 g/mol, XLogP of 0.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-3-(oxan-4-yl)propanamide is sourced from PubChem (CID 84578706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).