4-(3-methylidenecyclobutyl)pyridine

C10H11N — CID 76851339

IUPAC4-(3-methylidenecyclobutyl)pyridine
SMILESC=C1CC(c2ccncc2)C1
InChIInChI=1S/C10H11N/c1-8-6-10(7-8)9-2-4-11-5-3-9/h2-5,10H,1,6-7H2
InChIKeyIBXKXXNKCTUHBE-UHFFFAOYSA-N
MW145.20 g/mol
LogP2.52
Rot. Bonds1

About 4-(3-methylidenecyclobutyl)pyridine

4-(3-methylidenecyclobutyl)pyridine (PubChem CID 76851339) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 4-(3-methylidenecyclobutyl)pyridine.

Molecular Properties

Compound Name4-(3-methylidenecyclobutyl)pyridine
PubChem CID76851339
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name4-(3-methylidenecyclobutyl)pyridine
SMILESC=C1CC(c2ccncc2)C1
InChIInChI=1S/C10H11N/c1-8-6-10(7-8)9-2-4-11-5-3-9/h2-5,10H,1,6-7H2
InChIKeyIBXKXXNKCTUHBE-UHFFFAOYSA-N
XLogP2.52
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methylidenecyclobutyl)pyridine?
The IUPAC name of 4-(3-methylidenecyclobutyl)pyridine (CID 76851339) is 4-(3-methylidenecyclobutyl)pyridine.
What is the SMILES notation for 4-(3-methylidenecyclobutyl)pyridine?
The canonical SMILES for 4-(3-methylidenecyclobutyl)pyridine is C=C1CC(c2ccncc2)C1.
What is the InChIKey of 4-(3-methylidenecyclobutyl)pyridine?
The InChIKey is IBXKXXNKCTUHBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-8-6-10(7-8)9-2-4-11-5-3-9/h2-5,10H,1,6-7H2.
What are the key properties of 4-(3-methylidenecyclobutyl)pyridine?
4-(3-methylidenecyclobutyl)pyridine has a molecular weight of 145.20 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylidenecyclobutyl)pyridine is sourced from PubChem (CID 76851339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).