3-methyl-4-methylidenepyrrolidine

C6H11N — CID 55286286

IUPAC3-methyl-4-methylidenepyrrolidine
SMILESC=C1CNCC1C
InChIInChI=1S/C6H11N/c1-5-3-7-4-6(5)2/h6-7H,1,3-4H2,2H3
InChIKeyVKOFEDONJZOQPC-UHFFFAOYSA-N
MW97.16 g/mol
LogP0.78
Rot. Bonds

About 3-methyl-4-methylidenepyrrolidine

3-methyl-4-methylidenepyrrolidine (PubChem CID 55286286) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is 3-methyl-4-methylidenepyrrolidine.

Molecular Properties

Compound Name3-methyl-4-methylidenepyrrolidine
PubChem CID55286286
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Name3-methyl-4-methylidenepyrrolidine
SMILESC=C1CNCC1C
InChIInChI=1S/C6H11N/c1-5-3-7-4-6(5)2/h6-7H,1,3-4H2,2H3
InChIKeyVKOFEDONJZOQPC-UHFFFAOYSA-N
XLogP0.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3-methyl-4-methylidenepyrrolidine 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 3-methyl-4-methylidenepyrrolidine?
The IUPAC name of 3-methyl-4-methylidenepyrrolidine (CID 55286286) is 3-methyl-4-methylidenepyrrolidine.
What is the SMILES notation for 3-methyl-4-methylidenepyrrolidine?
The canonical SMILES for 3-methyl-4-methylidenepyrrolidine is C=C1CNCC1C.
What is the InChIKey of 3-methyl-4-methylidenepyrrolidine?
The InChIKey is VKOFEDONJZOQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N/c1-5-3-7-4-6(5)2/h6-7H,1,3-4H2,2H3.
What are the key properties of 3-methyl-4-methylidenepyrrolidine?
3-methyl-4-methylidenepyrrolidine has a molecular weight of 97.16 g/mol, XLogP of 0.78, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-methylidenepyrrolidine is sourced from PubChem (CID 55286286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).