4-methyl-4-azaspiro[2.4]hept-1-ene

C7H11N — CID 89353235

IUPAC4-methyl-4-azaspiro[2.4]hept-1-ene
SMILESCN1CCCC12C=C2
InChIInChI=1S/C7H11N/c1-8-6-2-3-7(8)4-5-7/h4-5H,2-3,6H2,1H3
InChIKeyVZWFXTIMHQJUBV-UHFFFAOYSA-N
MW109.17 g/mol
LogP1.02
Rot. Bonds

About 4-methyl-4-azaspiro[2.4]hept-1-ene

4-methyl-4-azaspiro[2.4]hept-1-ene (PubChem CID 89353235) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 4-methyl-4-azaspiro[2.4]hept-1-ene.

Molecular Properties

Compound Name4-methyl-4-azaspiro[2.4]hept-1-ene
PubChem CID89353235
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name4-methyl-4-azaspiro[2.4]hept-1-ene
SMILESCN1CCCC12C=C2
InChIInChI=1S/C7H11N/c1-8-6-2-3-7(8)4-5-7/h4-5H,2-3,6H2,1H3
InChIKeyVZWFXTIMHQJUBV-UHFFFAOYSA-N
XLogP1.02
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 ≤ 51.02
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-methyl-4-azaspiro[2.4]hept-1-ene?
The IUPAC name of 4-methyl-4-azaspiro[2.4]hept-1-ene (CID 89353235) is 4-methyl-4-azaspiro[2.4]hept-1-ene.
What is the SMILES notation for 4-methyl-4-azaspiro[2.4]hept-1-ene?
The canonical SMILES for 4-methyl-4-azaspiro[2.4]hept-1-ene is CN1CCCC12C=C2.
What is the InChIKey of 4-methyl-4-azaspiro[2.4]hept-1-ene?
The InChIKey is VZWFXTIMHQJUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-8-6-2-3-7(8)4-5-7/h4-5H,2-3,6H2,1H3.
What are the key properties of 4-methyl-4-azaspiro[2.4]hept-1-ene?
4-methyl-4-azaspiro[2.4]hept-1-ene has a molecular weight of 109.17 g/mol, XLogP of 1.02, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-azaspiro[2.4]hept-1-ene is sourced from PubChem (CID 89353235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).