6-methyl-6-azaspiro[2.4]hept-1-ene

C7H11N — CID 147002571

IUPAC6-methyl-6-azaspiro[2.4]hept-1-ene
SMILESCN1CCC2(C=C2)C1
InChIInChI=1S/C7H11N/c1-8-5-4-7(6-8)2-3-7/h2-3H,4-6H2,1H3
InChIKeyASHXMUUNMNYFPO-UHFFFAOYSA-N
MW109.17 g/mol
LogP0.88
Rot. Bonds

About 6-methyl-6-azaspiro[2.4]hept-1-ene

6-methyl-6-azaspiro[2.4]hept-1-ene (PubChem CID 147002571) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 6-methyl-6-azaspiro[2.4]hept-1-ene.

Molecular Properties

Compound Name6-methyl-6-azaspiro[2.4]hept-1-ene
PubChem CID147002571
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name6-methyl-6-azaspiro[2.4]hept-1-ene
SMILESCN1CCC2(C=C2)C1
InChIInChI=1S/C7H11N/c1-8-5-4-7(6-8)2-3-7/h2-3H,4-6H2,1H3
InChIKeyASHXMUUNMNYFPO-UHFFFAOYSA-N
XLogP0.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 50.88
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 6-methyl-6-azaspiro[2.4]hept-1-ene?
The IUPAC name of 6-methyl-6-azaspiro[2.4]hept-1-ene (CID 147002571) is 6-methyl-6-azaspiro[2.4]hept-1-ene.
What is the SMILES notation for 6-methyl-6-azaspiro[2.4]hept-1-ene?
The canonical SMILES for 6-methyl-6-azaspiro[2.4]hept-1-ene is CN1CCC2(C=C2)C1.
What is the InChIKey of 6-methyl-6-azaspiro[2.4]hept-1-ene?
The InChIKey is ASHXMUUNMNYFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-8-5-4-7(6-8)2-3-7/h2-3H,4-6H2,1H3.
What are the key properties of 6-methyl-6-azaspiro[2.4]hept-1-ene?
6-methyl-6-azaspiro[2.4]hept-1-ene has a molecular weight of 109.17 g/mol, XLogP of 0.88, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-6-azaspiro[2.4]hept-1-ene is sourced from PubChem (CID 147002571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).