[(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane

C18H30 — CID 58552469

IUPAC[(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane
SMILESC(=C1\CCCC1C1CCCCC1)\C1CCCCC1
InChIInChI=1S/C18H30/c1-3-8-15(9-4-1)14-17-12-7-13-18(17)16-10-5-2-6-11-16/h14-16,18H,1-13H2/b17-14+
InChIKeyJFQWGBUJJDGOJF-SAPNQHFASA-N
MW246.44 g/mol
LogP5.87
Rot. Bonds2

About [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane

[(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane (PubChem CID 58552469) has the molecular formula C18H30 and a molecular weight of 246.44 g/mol. Its IUPAC name is [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane.

Molecular Properties

Compound Name[(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane
PubChem CID58552469
Molecular FormulaC18H30
Molecular Weight246.44 g/mol
Exact Mass246.23
IUPAC Name[(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane
SMILESC(=C1\CCCC1C1CCCCC1)\C1CCCCC1
InChIInChI=1S/C18H30/c1-3-8-15(9-4-1)14-17-12-7-13-18(17)16-10-5-2-6-11-16/h14-16,18H,1-13H2/b17-14+
InChIKeyJFQWGBUJJDGOJF-SAPNQHFASA-N
XLogP5.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500246.44
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1S,2E)-2-(cyclohexylmethylidene)cyclopentan-1-ol
CID 11542876
(8E)-8-benzylidene-2,3,4,4a,5,6,7,8a-octahydro-1H-naphthalene
CID 13164040
1-[(3E)-3-(cyclohexylmethylidene)-2-methylcyclohexyl]ethanamine
CID 145204265
cyclopropylidenemethylcyclopentane
CID 148648629
[2-(cyclohexylmethylidene)cyclopropyl]hydrazine
CID 150252564
(3aR,10aS)-2,3,3a,5,6,7,8,9,10,10a-decahydro-1H-cyclopenta[9]annulen-4-one
CID 102063189
trans-(2S,6S)-2,6-dicyclohexylcyclohexan-1-one
CID 36691423
2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-naphthalen-1-ylidene]propanedinitrile
CID 91697608
(2E,8E)-2,8-bis(cyclohexylmethylidene)cyclooctan-1-one
CID 6446444
2-(cyclohexylmethylidene)oxirane
CID 71369690
1-cycloheptyl-2-propan-2-ylidenecycloheptane
CID 21463896
1,2,3a,4,5,6,7,8,9,9a-decahydrocyclopenta[8]annulen-3-imine
CID 143341086

Frequently Asked Questions

What is the IUPAC name of [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane?
The IUPAC name of [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane (CID 58552469) is [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane.
What is the SMILES notation for [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane?
The canonical SMILES for [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane is C(=C1\CCCC1C1CCCCC1)\C1CCCCC1.
What is the InChIKey of [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane?
The InChIKey is JFQWGBUJJDGOJF-SAPNQHFASA-N. The full InChI is InChI=1S/C18H30/c1-3-8-15(9-4-1)14-17-12-7-13-18(17)16-10-5-2-6-11-16/h14-16,18H,1-13H2/b17-14+.
What are the key properties of [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane?
[(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane has a molecular weight of 246.44 g/mol, XLogP of 5.87, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-(2-cyclohexylcyclopentylidene)methyl]cyclohexane is sourced from PubChem (CID 58552469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).