(2-methylcyclohexylidene)cycloheptane

C14H24 — CID 57190627

IUPAC(2-methylcyclohexylidene)cycloheptane
SMILESCC1CCCCC1=C1CCCCCC1
InChIInChI=1S/C14H24/c1-12-8-6-7-11-14(12)13-9-4-2-3-5-10-13/h12H,2-11H2,1H3
InChIKeyKXJCFDLFGUYAGO-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.85
Rot. Bonds

About (2-methylcyclohexylidene)cycloheptane

(2-methylcyclohexylidene)cycloheptane (PubChem CID 57190627) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is (2-methylcyclohexylidene)cycloheptane.

Molecular Properties

Compound Name(2-methylcyclohexylidene)cycloheptane
PubChem CID57190627
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name(2-methylcyclohexylidene)cycloheptane
SMILESCC1CCCCC1=C1CCCCCC1
InChIInChI=1S/C14H24/c1-12-8-6-7-11-14(12)13-9-4-2-3-5-10-13/h12H,2-11H2,1H3
InChIKeyKXJCFDLFGUYAGO-UHFFFAOYSA-N
XLogP4.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.85
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

p-Menth-4(8)-ene
CID 517975
m-Menth-3(8)-ene
CID 518828
7-(1-Methylethylidene)bicyclo(4.1.0)heptane
CID 40707
Cyclohexane, (2-methyl-1-propenyl)-
CID 549098
trans-(1S,2S)-1,2-diethyl-4-propan-2-ylidenecyclohexane
CID 162882634
1,2,3-Trimethylcyclohex-1-ene
CID 12537123
(1Z)-1-ethylidene-2-methylcyclohexane
CID 13028908
(1E)-1-ethylidene-2-methylcyclohexane
CID 13028907
(2Z)-1-methyl-2-propylidenecyclohexane
CID 21719228
Cyclohexane, (2-ethyl-1-methylbutylidene)-
CID 565721
7-Propylidene-bicyclo[4.1.0]heptane
CID 556456
Bicyclo(4.1.0)heptane, 7-(2-methyl-1-propenylidene)-
CID 138290

Frequently Asked Questions

What is the IUPAC name of (2-methylcyclohexylidene)cycloheptane?
The IUPAC name of (2-methylcyclohexylidene)cycloheptane (CID 57190627) is (2-methylcyclohexylidene)cycloheptane.
What is the SMILES notation for (2-methylcyclohexylidene)cycloheptane?
The canonical SMILES for (2-methylcyclohexylidene)cycloheptane is CC1CCCCC1=C1CCCCCC1.
What is the InChIKey of (2-methylcyclohexylidene)cycloheptane?
The InChIKey is KXJCFDLFGUYAGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-12-8-6-7-11-14(12)13-9-4-2-3-5-10-13/h12H,2-11H2,1H3.
What are the key properties of (2-methylcyclohexylidene)cycloheptane?
(2-methylcyclohexylidene)cycloheptane has a molecular weight of 192.35 g/mol, XLogP of 4.85, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclohexylidene)cycloheptane is sourced from PubChem (CID 57190627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).