3-(cyclobutylidenemethyl)piperidine

C10H17N — CID 86775656

IUPAC3-(cyclobutylidenemethyl)piperidine
SMILESC(=C1CCC1)C1CCCNC1
InChIInChI=1S/C10H17N/c1-3-9(4-1)7-10-5-2-6-11-8-10/h7,10-11H,1-6,8H2
InChIKeyPNQBJPFJSUWDBO-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.10
Rot. Bonds1

About 3-(cyclobutylidenemethyl)piperidine

3-(cyclobutylidenemethyl)piperidine (PubChem CID 86775656) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 3-(cyclobutylidenemethyl)piperidine.

Molecular Properties

Compound Name3-(cyclobutylidenemethyl)piperidine
PubChem CID86775656
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name3-(cyclobutylidenemethyl)piperidine
SMILESC(=C1CCC1)C1CCCNC1
InChIInChI=1S/C10H17N/c1-3-9(4-1)7-10-5-2-6-11-8-10/h7,10-11H,1-6,8H2
InChIKeyPNQBJPFJSUWDBO-UHFFFAOYSA-N
XLogP2.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3-(cyclobutylidenemethyl)piperidine 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-(cyclobutylidenemethyl)piperidine?
The IUPAC name of 3-(cyclobutylidenemethyl)piperidine (CID 86775656) is 3-(cyclobutylidenemethyl)piperidine.
What is the SMILES notation for 3-(cyclobutylidenemethyl)piperidine?
The canonical SMILES for 3-(cyclobutylidenemethyl)piperidine is C(=C1CCC1)C1CCCNC1.
What is the InChIKey of 3-(cyclobutylidenemethyl)piperidine?
The InChIKey is PNQBJPFJSUWDBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-3-9(4-1)7-10-5-2-6-11-8-10/h7,10-11H,1-6,8H2.
What are the key properties of 3-(cyclobutylidenemethyl)piperidine?
3-(cyclobutylidenemethyl)piperidine has a molecular weight of 151.25 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylidenemethyl)piperidine is sourced from PubChem (CID 86775656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).