1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one

C9H13NO — CID 123897961

IUPAC1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one
SMILESC=C1C(=O)N(C2CC2)CC1C
InChIInChI=1S/C9H13NO/c1-6-5-10(8-3-4-8)9(11)7(6)2/h6,8H,2-5H2,1H3
InChIKeyGBGMCADCTGDCMD-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.18
Rot. Bonds1

About 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one

1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one (PubChem CID 123897961) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one
PubChem CID123897961
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one
SMILESC=C1C(=O)N(C2CC2)CC1C
InChIInChI=1S/C9H13NO/c1-6-5-10(8-3-4-8)9(11)7(6)2/h6,8H,2-5H2,1H3
InChIKeyGBGMCADCTGDCMD-UHFFFAOYSA-N
XLogP1.18
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one 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

1-Methyl-3-methylidenepyrrolidin-2-one
CID 10844354
1-Tert-butyl-4-methylidenepyrrolidin-2-one
CID 138969437
3-Methylidene-1-propan-2-ylpyrrolidin-2-one
CID 10129998
1,4-Dimethyl-3-methylidenepyrrolidin-2-one
CID 12294828
1-Ethyl-4-methyl-3-methylidenepyrrolidin-2-one
CID 12294829
1,3-Dimethyl-4-methylidenepyrrolidin-2-one
CID 12294832
1-Butyl-3-methylidenepyrrolidin-2-one
CID 14356465
1-Ethyl-3-methylidenepyrrolidin-2-one
CID 23088886
1-Tert-butyl-3-methylidenepyrrolidin-2-one
CID 23088890
2,5-Pyrrolidinedione, 3-methylene-1-(1-methylethyl)-
CID 45095915
1-Methyl-3,4-dimethylidenepyrrolidin-2-one
CID 59912760
3-Methylidene-1-propylpyrrolidin-2-one
CID 66707467

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one?
The IUPAC name of 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one (CID 123897961) is 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one.
What is the SMILES notation for 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one?
The canonical SMILES for 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one is C=C1C(=O)N(C2CC2)CC1C.
What is the InChIKey of 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one?
The InChIKey is GBGMCADCTGDCMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-6-5-10(8-3-4-8)9(11)7(6)2/h6,8H,2-5H2,1H3.
What are the key properties of 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one?
1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one has a molecular weight of 151.21 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4-methyl-3-methylidenepyrrolidin-2-one is sourced from PubChem (CID 123897961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).