6-methylhept-5-en-2-ylcyclopropane

C11H20 — CID 134961142

IUPAC6-methylhept-5-en-2-ylcyclopropane
SMILESCC(C)=CCCC(C)C1CC1
InChIInChI=1S/C11H20/c1-9(2)5-4-6-10(3)11-7-8-11/h5,10-11H,4,6-8H2,1-3H3
InChIKeyLJRDWEKNIHIEIM-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.78
Rot. Bonds4

About 6-methylhept-5-en-2-ylcyclopropane

6-methylhept-5-en-2-ylcyclopropane (PubChem CID 134961142) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 6-methylhept-5-en-2-ylcyclopropane.

Molecular Properties

Compound Name6-methylhept-5-en-2-ylcyclopropane
PubChem CID134961142
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name6-methylhept-5-en-2-ylcyclopropane
SMILESCC(C)=CCCC(C)C1CC1
InChIInChI=1S/C11H20/c1-9(2)5-4-6-10(3)11-7-8-11/h5,10-11H,4,6-8H2,1-3H3
InChIKeyLJRDWEKNIHIEIM-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.78
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 6-methylhept-5-en-2-ylcyclopropane?
The IUPAC name of 6-methylhept-5-en-2-ylcyclopropane (CID 134961142) is 6-methylhept-5-en-2-ylcyclopropane.
What is the SMILES notation for 6-methylhept-5-en-2-ylcyclopropane?
The canonical SMILES for 6-methylhept-5-en-2-ylcyclopropane is CC(C)=CCCC(C)C1CC1.
What is the InChIKey of 6-methylhept-5-en-2-ylcyclopropane?
The InChIKey is LJRDWEKNIHIEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-9(2)5-4-6-10(3)11-7-8-11/h5,10-11H,4,6-8H2,1-3H3.
What are the key properties of 6-methylhept-5-en-2-ylcyclopropane?
6-methylhept-5-en-2-ylcyclopropane has a molecular weight of 152.28 g/mol, XLogP of 3.78, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylhept-5-en-2-ylcyclopropane is sourced from PubChem (CID 134961142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).