1-(cyclopropylmethyl)-4-methylidenecyclohexane

C11H18 — CID 148572856

IUPAC1-(cyclopropylmethyl)-4-methylidenecyclohexane
SMILESC=C1CCC(CC2CC2)CC1
InChIInChI=1S/C11H18/c1-9-2-4-10(5-3-9)8-11-6-7-11/h10-11H,1-8H2
InChIKeyMXFHJLKZWGZLOY-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.53
Rot. Bonds2

About 1-(cyclopropylmethyl)-4-methylidenecyclohexane

1-(cyclopropylmethyl)-4-methylidenecyclohexane (PubChem CID 148572856) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4-methylidenecyclohexane.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-4-methylidenecyclohexane
PubChem CID148572856
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name1-(cyclopropylmethyl)-4-methylidenecyclohexane
SMILESC=C1CCC(CC2CC2)CC1
InChIInChI=1S/C11H18/c1-9-2-4-10(5-3-9)8-11-6-7-11/h10-11H,1-8H2
InChIKeyMXFHJLKZWGZLOY-UHFFFAOYSA-N
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.53
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 1-(cyclopropylmethyl)-4-methylidenecyclohexane?
The IUPAC name of 1-(cyclopropylmethyl)-4-methylidenecyclohexane (CID 148572856) is 1-(cyclopropylmethyl)-4-methylidenecyclohexane.
What is the SMILES notation for 1-(cyclopropylmethyl)-4-methylidenecyclohexane?
The canonical SMILES for 1-(cyclopropylmethyl)-4-methylidenecyclohexane is C=C1CCC(CC2CC2)CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-4-methylidenecyclohexane?
The InChIKey is MXFHJLKZWGZLOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-9-2-4-10(5-3-9)8-11-6-7-11/h10-11H,1-8H2.
What are the key properties of 1-(cyclopropylmethyl)-4-methylidenecyclohexane?
1-(cyclopropylmethyl)-4-methylidenecyclohexane has a molecular weight of 150.26 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-4-methylidenecyclohexane is sourced from PubChem (CID 148572856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).