[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane

C14H24 — CID 142840542

IUPAC[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane
SMILESCC/C(=C\C=C(C)C)C1CCCCC1
InChIInChI=1S/C14H24/c1-4-13(11-10-12(2)3)14-8-6-5-7-9-14/h10-11,14H,4-9H2,1-3H3/b13-11+
InChIKeyWTLOHSHXOYGNKX-ACCUITESSA-N
MW192.35 g/mol
LogP4.87
Rot. Bonds3

About [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane

[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane (PubChem CID 142840542) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane.

Molecular Properties

Compound Name[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane
PubChem CID142840542
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane
SMILESCC/C(=C\C=C(C)C)C1CCCCC1
InChIInChI=1S/C14H24/c1-4-13(11-10-12(2)3)14-8-6-5-7-9-14/h10-11,14H,4-9H2,1-3H3/b13-11+
InChIKeyWTLOHSHXOYGNKX-ACCUITESSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E)-5-cyclohexyl-2-ethenylhepta-2,4-dienamide
CID 130460991
[(3E)-hexa-3,5-dien-3-yl]cyclopropane
CID 13014702
6-chloroocta-3,5,7-trien-3-ylcyclopropane
CID 123269942
1-cyclopentylethanone;propane
CID 145026358
(E)-1-cyclohexyl-2-ethylbut-2-en-1-one
CID 24977366
ethane;[(3E)-6-methylhepta-1,3,5-trien-3-yl] cyclohexanecarboxylate
CID 145229171
[(2Z)-1-methoxy-4-[(3E)-6-methylhepta-1,3,5-trien-4-yl]oxypenta-2,4-dien-2-yl]cyclohexane
CID 143963194
(Z)-3-cyclohexyl-2-ethylbut-2-enoic acid
CID 165441204
3-cyclohexyl-2-methylpent-2-enethioic S-acid
CID 54517934
2-cyclohexyl-4-methylhex-2-en-1-ol
CID 115825399
1-cyclohexylhex-1-en-2-ylcyclohexane
CID 164897102
(E)-1-cyclohexyl-2-methylhex-2-en-1-one
CID 10878042

Frequently Asked Questions

What is the IUPAC name of [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane?
The IUPAC name of [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane (CID 142840542) is [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane.
What is the SMILES notation for [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane?
The canonical SMILES for [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane is CC/C(=C\C=C(C)C)C1CCCCC1.
What is the InChIKey of [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane?
The InChIKey is WTLOHSHXOYGNKX-ACCUITESSA-N. The full InChI is InChI=1S/C14H24/c1-4-13(11-10-12(2)3)14-8-6-5-7-9-14/h10-11,14H,4-9H2,1-3H3/b13-11+.
What are the key properties of [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane?
[(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane has a molecular weight of 192.35 g/mol, XLogP of 4.87, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E)-6-methylhepta-3,5-dien-3-yl]cyclohexane is sourced from PubChem (CID 142840542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).