cyclopent-2-en-1-ylideneazanium

C5H8N+ — CID 134849200

IUPACcyclopent-2-en-1-ylideneazanium
SMILES[NH2+]=C1C=CCC1
InChIInChI=1S/C5H7N/c6-5-3-1-2-4-5/h1,3,6H,2,4H2/p+1
InChIKeyXWTGDXKDFFPFGM-UHFFFAOYSA-O
MW82.13 g/mol
LogP-0.46
Rot. Bonds

About cyclopent-2-en-1-ylideneazanium

cyclopent-2-en-1-ylideneazanium (PubChem CID 134849200) has the molecular formula C5H8N+ and a molecular weight of 82.13 g/mol. Its IUPAC name is cyclopent-2-en-1-ylideneazanium.

Molecular Properties

Compound Namecyclopent-2-en-1-ylideneazanium
PubChem CID134849200
Molecular FormulaC5H8N+
Molecular Weight82.13 g/mol
Exact Mass82.07
IUPAC Namecyclopent-2-en-1-ylideneazanium
SMILES[NH2+]=C1C=CCC1
InChIInChI=1S/C5H7N/c6-5-3-1-2-4-5/h1,3,6H,2,4H2/p+1
InChIKeyXWTGDXKDFFPFGM-UHFFFAOYSA-O
XLogP-0.46
TPSA25.59 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50082.13
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cyclopent-2-en-1-ylideneazanium 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 cyclopent-2-en-1-ylideneazanium?
The IUPAC name of cyclopent-2-en-1-ylideneazanium (CID 134849200) is cyclopent-2-en-1-ylideneazanium.
What is the SMILES notation for cyclopent-2-en-1-ylideneazanium?
The canonical SMILES for cyclopent-2-en-1-ylideneazanium is [NH2+]=C1C=CCC1.
What is the InChIKey of cyclopent-2-en-1-ylideneazanium?
The InChIKey is XWTGDXKDFFPFGM-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H7N/c6-5-3-1-2-4-5/h1,3,6H,2,4H2/p+1.
What are the key properties of cyclopent-2-en-1-ylideneazanium?
cyclopent-2-en-1-ylideneazanium has a molecular weight of 82.13 g/mol, XLogP of -0.46, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-2-en-1-ylideneazanium is sourced from PubChem (CID 134849200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).