2-cyclopropyl-2-methylspiro[2.4]hept-6-ene

C11H16 — CID 10419341

IUPAC2-cyclopropyl-2-methylspiro[2.4]hept-6-ene
SMILESCC1(C2CC2)CC12C=CCC2
InChIInChI=1S/C11H16/c1-10(9-4-5-9)8-11(10)6-2-3-7-11/h2,6,9H,3-5,7-8H2,1H3
InChIKeyMFHJJOPGVABALU-UHFFFAOYSA-N
MW148.25 g/mol
LogP3.14
Rot. Bonds1

About 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene

2-cyclopropyl-2-methylspiro[2.4]hept-6-ene (PubChem CID 10419341) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene.

Molecular Properties

Compound Name2-cyclopropyl-2-methylspiro[2.4]hept-6-ene
PubChem CID10419341
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name2-cyclopropyl-2-methylspiro[2.4]hept-6-ene
SMILESCC1(C2CC2)CC12C=CCC2
InChIInChI=1S/C11H16/c1-10(9-4-5-9)8-11(10)6-2-3-7-11/h2,6,9H,3-5,7-8H2,1H3
InChIKeyMFHJJOPGVABALU-UHFFFAOYSA-N
XLogP3.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene?
The IUPAC name of 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene (CID 10419341) is 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene.
What is the SMILES notation for 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene?
The canonical SMILES for 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene is CC1(C2CC2)CC12C=CCC2.
What is the InChIKey of 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene?
The InChIKey is MFHJJOPGVABALU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-10(9-4-5-9)8-11(10)6-2-3-7-11/h2,6,9H,3-5,7-8H2,1H3.
What are the key properties of 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene?
2-cyclopropyl-2-methylspiro[2.4]hept-6-ene has a molecular weight of 148.25 g/mol, XLogP of 3.14, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methylspiro[2.4]hept-6-ene is sourced from PubChem (CID 10419341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).