(4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene

C12H18 — CID 162918166

IUPAC(4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene
SMILESC=C[C@@]1(C)CCC=CC1=C(C)C
InChIInChI=1S/C12H18/c1-5-12(4)9-7-6-8-11(12)10(2)3/h5-6,8H,1,7,9H2,2-4H3/t12-/m0/s1
InChIKeyDDDUDPZNWNWAHI-LBPRGKRZSA-N
MW162.28 g/mol
LogP3.87
Rot. Bonds1

About (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene

(4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene (PubChem CID 162918166) has the molecular formula C12H18 and a molecular weight of 162.28 g/mol. Its IUPAC name is (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene.

Molecular Properties

Compound Name(4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene
PubChem CID162918166
Molecular FormulaC12H18
Molecular Weight162.28 g/mol
Exact Mass162.14
IUPAC Name(4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene
SMILESC=C[C@@]1(C)CCC=CC1=C(C)C
InChIInChI=1S/C12H18/c1-5-12(4)9-7-6-8-11(12)10(2)3/h5-6,8H,1,7,9H2,2-4H3/t12-/m0/s1
InChIKeyDDDUDPZNWNWAHI-LBPRGKRZSA-N
XLogP3.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.28
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene?
The IUPAC name of (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene (CID 162918166) is (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene.
What is the SMILES notation for (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene?
The canonical SMILES for (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene is C=C[C@@]1(C)CCC=CC1=C(C)C.
What is the InChIKey of (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene?
The InChIKey is DDDUDPZNWNWAHI-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H18/c1-5-12(4)9-7-6-8-11(12)10(2)3/h5-6,8H,1,7,9H2,2-4H3/t12-/m0/s1.
What are the key properties of (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene?
(4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene has a molecular weight of 162.28 g/mol, XLogP of 3.87, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-ethenyl-4-methyl-3-propan-2-ylidenecyclohexene is sourced from PubChem (CID 162918166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).