N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide

C7H14N2O2 — CID 69140569

IUPACN-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide
SMILESCC(=O)N(C)C1NCCC1O
InChIInChI=1S/C7H14N2O2/c1-5(10)9(2)7-6(11)3-4-8-7/h6-8,11H,3-4H2,1-2H3
InChIKeyWJTRSEXHTVYNOO-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.86
Rot. Bonds1

About N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide

N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide (PubChem CID 69140569) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide
PubChem CID69140569
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC NameN-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide
SMILESCC(=O)N(C)C1NCCC1O
InChIInChI=1S/C7H14N2O2/c1-5(10)9(2)7-6(11)3-4-8-7/h6-8,11H,3-4H2,1-2H3
InChIKeyWJTRSEXHTVYNOO-UHFFFAOYSA-N
XLogP-0.86
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide 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-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide?
The IUPAC name of N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide (CID 69140569) is N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide.
What is the SMILES notation for N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide?
The canonical SMILES for N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide is CC(=O)N(C)C1NCCC1O.
What is the InChIKey of N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide?
The InChIKey is WJTRSEXHTVYNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-5(10)9(2)7-6(11)3-4-8-7/h6-8,11H,3-4H2,1-2H3.
What are the key properties of N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide?
N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide has a molecular weight of 158.20 g/mol, XLogP of -0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypyrrolidin-2-yl)-N-methylacetamide is sourced from PubChem (CID 69140569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).