(4E)-4-ethylidenepyrrolidin-3-imine

C6H10N2 — CID 177149075

IUPAC(4E)-4-ethylidenepyrrolidin-3-imine
SMILES[H]/N=C1\CNC\C1=C/C
InChIInChI=1S/C6H10N2/c1-2-5-3-8-4-6(5)7/h2,7-8H,3-4H2,1H3/b5-2+,7-6+
InChIKeyNVZCMGNTXDLCTB-IKEBSSOGSA-N
MW110.16 g/mol
LogP0.56
Rot. Bonds

About (4E)-4-ethylidenepyrrolidin-3-imine

(4E)-4-ethylidenepyrrolidin-3-imine (PubChem CID 177149075) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is (4E)-4-ethylidenepyrrolidin-3-imine.

Molecular Properties

Compound Name(4E)-4-ethylidenepyrrolidin-3-imine
PubChem CID177149075
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name(4E)-4-ethylidenepyrrolidin-3-imine
SMILES[H]/N=C1\CNC\C1=C/C
InChIInChI=1S/C6H10N2/c1-2-5-3-8-4-6(5)7/h2,7-8H,3-4H2,1H3/b5-2+,7-6+
InChIKeyNVZCMGNTXDLCTB-IKEBSSOGSA-N
XLogP0.56
TPSA35.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (4E)-4-ethylidenepyrrolidin-3-imine 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 (4E)-4-ethylidenepyrrolidin-3-imine?
The IUPAC name of (4E)-4-ethylidenepyrrolidin-3-imine (CID 177149075) is (4E)-4-ethylidenepyrrolidin-3-imine.
What is the SMILES notation for (4E)-4-ethylidenepyrrolidin-3-imine?
The canonical SMILES for (4E)-4-ethylidenepyrrolidin-3-imine is [H]/N=C1\CNC\C1=C/C.
What is the InChIKey of (4E)-4-ethylidenepyrrolidin-3-imine?
The InChIKey is NVZCMGNTXDLCTB-IKEBSSOGSA-N. The full InChI is InChI=1S/C6H10N2/c1-2-5-3-8-4-6(5)7/h2,7-8H,3-4H2,1H3/b5-2+,7-6+.
What are the key properties of (4E)-4-ethylidenepyrrolidin-3-imine?
(4E)-4-ethylidenepyrrolidin-3-imine has a molecular weight of 110.16 g/mol, XLogP of 0.56, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-4-ethylidenepyrrolidin-3-imine is sourced from PubChem (CID 177149075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).