(1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane

C15H24 — CID 10242027

IUPAC(1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane
SMILESCC(C)=C/C=C1\CCCCC1C=C(C)C
InChIInChI=1S/C15H24/c1-12(2)9-10-14-7-5-6-8-15(14)11-13(3)4/h9-11,15H,5-8H2,1-4H3/b14-10+
InChIKeyBQIBHPGCHITJJN-GXDHUFHOSA-N
MW204.36 g/mol
LogP5.04
Rot. Bonds2

About (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane

(1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane (PubChem CID 10242027) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane.

Molecular Properties

Compound Name(1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane
PubChem CID10242027
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane
SMILESCC(C)=C/C=C1\CCCCC1C=C(C)C
InChIInChI=1S/C15H24/c1-12(2)9-10-14-7-5-6-8-15(14)11-13(3)4/h9-11,15H,5-8H2,1-4H3/b14-10+
InChIKeyBQIBHPGCHITJJN-GXDHUFHOSA-N
XLogP5.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500204.36
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane with MolForge

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

Launch Full Analysis

Related Compounds

(1E)-1-[(E)-but-2-enylidene]-2-(2-methylprop-1-enyl)cyclohexane
CID 102151765
1-but-2-enylidene-2-prop-1-enylcyclopentane
CID 131859563
[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane
CID 142840542
cyclopropyl-[2-methyl-5-(2-methylprop-1-enyl)cyclopenten-1-yl]methanone
CID 135067667
2-ethylidenecyclopentan-1-ol
CID 72740887
(1E,2S)-1-ethylidene-2-methylcyclohexane
CID 148695286
3-(2-methylprop-1-enyl)pyrrolidin-2-one
CID 70521733
1-[(2E)-2-ethylidenecyclohexyl]propan-2-one
CID 15472619
2-(2-methylprop-1-enyl)cyclohexan-1-amine
CID 544838
2-ethylidenecyclohexane-1-carboxylic acid
CID 57189544
(2E)-2-[(2S)-2-methylcyclohexylidene]acetic acid
CID 12956886
2-cyclopropylidenecyclohexan-1-ol
CID 71322979

Frequently Asked Questions

What is the IUPAC name of (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane?
The IUPAC name of (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane (CID 10242027) is (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane.
What is the SMILES notation for (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane?
The canonical SMILES for (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane is CC(C)=C/C=C1\CCCCC1C=C(C)C.
What is the InChIKey of (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane?
The InChIKey is BQIBHPGCHITJJN-GXDHUFHOSA-N. The full InChI is InChI=1S/C15H24/c1-12(2)9-10-14-7-5-6-8-15(14)11-13(3)4/h9-11,15H,5-8H2,1-4H3/b14-10+.
What are the key properties of (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane?
(1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane has a molecular weight of 204.36 g/mol, XLogP of 5.04, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-(3-methylbut-2-enylidene)-2-(2-methylprop-1-enyl)cyclohexane is sourced from PubChem (CID 10242027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).