N-methylcyclopent-3-en-1-amine

C6H11N — CID 21306607

IUPACN-methylcyclopent-3-en-1-amine
SMILESCNC1CC=CC1
InChIInChI=1S/C6H11N/c1-7-6-4-2-3-5-6/h2-3,6-7H,4-5H2,1H3
InChIKeyVFSJDHDSAIQLMF-UHFFFAOYSA-N
MW97.16 g/mol
LogP0.92
Rot. Bonds1

About N-methylcyclopent-3-en-1-amine

N-methylcyclopent-3-en-1-amine (PubChem CID 21306607) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is N-methylcyclopent-3-en-1-amine.

Molecular Properties

Compound NameN-methylcyclopent-3-en-1-amine
PubChem CID21306607
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC NameN-methylcyclopent-3-en-1-amine
SMILESCNC1CC=CC1
InChIInChI=1S/C6H11N/c1-7-6-4-2-3-5-6/h2-3,6-7H,4-5H2,1H3
InChIKeyVFSJDHDSAIQLMF-UHFFFAOYSA-N
XLogP0.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methylcyclopent-3-en-1-amine 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 N-methylcyclopent-3-en-1-amine?
The IUPAC name of N-methylcyclopent-3-en-1-amine (CID 21306607) is N-methylcyclopent-3-en-1-amine.
What is the SMILES notation for N-methylcyclopent-3-en-1-amine?
The canonical SMILES for N-methylcyclopent-3-en-1-amine is CNC1CC=CC1.
What is the InChIKey of N-methylcyclopent-3-en-1-amine?
The InChIKey is VFSJDHDSAIQLMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N/c1-7-6-4-2-3-5-6/h2-3,6-7H,4-5H2,1H3.
What are the key properties of N-methylcyclopent-3-en-1-amine?
N-methylcyclopent-3-en-1-amine has a molecular weight of 97.16 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylcyclopent-3-en-1-amine is sourced from PubChem (CID 21306607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).