2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide

C11H18N2O2 — CID 68757114

IUPAC2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1C(=O)CCC1(C)C
InChIInChI=1S/C11H18N2O2/c1-4-7-12-9(14)8-13-10(15)5-6-11(13,2)3/h4H,1,5-8H2,2-3H3,(H,12,14)
InChIKeyRRHOTCRADKCIIW-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.69
Rot. Bonds4

About 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide

2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide (PubChem CID 68757114) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide
PubChem CID68757114
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1C(=O)CCC1(C)C
InChIInChI=1S/C11H18N2O2/c1-4-7-12-9(14)8-13-10(15)5-6-11(13,2)3/h4H,1,5-8H2,2-3H3,(H,12,14)
InChIKeyRRHOTCRADKCIIW-UHFFFAOYSA-N
XLogP0.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide 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 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide?
The IUPAC name of 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide (CID 68757114) is 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide?
The canonical SMILES for 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide is C=CCNC(=O)CN1C(=O)CCC1(C)C.
What is the InChIKey of 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide?
The InChIKey is RRHOTCRADKCIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-4-7-12-9(14)8-13-10(15)5-6-11(13,2)3/h4H,1,5-8H2,2-3H3,(H,12,14).
What are the key properties of 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide?
2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide has a molecular weight of 210.28 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-prop-2-enylacetamide is sourced from PubChem (CID 68757114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).