nonan-5-ylidenecyclohexane

C15H28 — CID 11195144

IUPACnonan-5-ylidenecyclohexane
SMILESCCCCC(CCCC)=C1CCCCC1
InChIInChI=1S/C15H28/c1-3-5-10-14(11-6-4-2)15-12-8-7-9-13-15/h3-13H2,1-2H3
InChIKeyIXUXXVWBRHSNJQ-UHFFFAOYSA-N
MW208.39 g/mol
LogP5.63
Rot. Bonds6

About nonan-5-ylidenecyclohexane

nonan-5-ylidenecyclohexane (PubChem CID 11195144) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is nonan-5-ylidenecyclohexane.

Molecular Properties

Compound Namenonan-5-ylidenecyclohexane
PubChem CID11195144
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Namenonan-5-ylidenecyclohexane
SMILESCCCCC(CCCC)=C1CCCCC1
InChIInChI=1S/C15H28/c1-3-5-10-14(11-6-4-2)15-12-8-7-9-13-15/h3-13H2,1-2H3
InChIKeyIXUXXVWBRHSNJQ-UHFFFAOYSA-N
XLogP5.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.63
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

Cyclopentene, 1-ethyl-2-methyl-
CID 88243
1,2-Dimethylcyclohexene
CID 15480
Cyclohexene, 1-pentyl-
CID 139915
Cyclohexene, 1-ethyl-2-methyl-
CID 88242
Cyclohexene, 1-propyl-
CID 107833
2-Heptene, 2,3-dimethyl-
CID 137816
Cyclohexene, 1-butyl-
CID 137878
Cyclohexene, 1-hexyl-
CID 138084
Cyclohexane, (1-methylethylidene)-
CID 138578
1-Heptylcyclohexene
CID 139916
2-Octene, 2,3-dimethyl-
CID 140599
Cyclohexene, 1-octyl-
CID 519088

Frequently Asked Questions

What is the IUPAC name of nonan-5-ylidenecyclohexane?
The IUPAC name of nonan-5-ylidenecyclohexane (CID 11195144) is nonan-5-ylidenecyclohexane.
What is the SMILES notation for nonan-5-ylidenecyclohexane?
The canonical SMILES for nonan-5-ylidenecyclohexane is CCCCC(CCCC)=C1CCCCC1.
What is the InChIKey of nonan-5-ylidenecyclohexane?
The InChIKey is IXUXXVWBRHSNJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-3-5-10-14(11-6-4-2)15-12-8-7-9-13-15/h3-13H2,1-2H3.
What are the key properties of nonan-5-ylidenecyclohexane?
nonan-5-ylidenecyclohexane has a molecular weight of 208.39 g/mol, XLogP of 5.63, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for nonan-5-ylidenecyclohexane is sourced from PubChem (CID 11195144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).