2,5-dimethyl-1,3-dimethylidenecyclohexane

C10H16 — CID 140827340

IUPAC2,5-dimethyl-1,3-dimethylidenecyclohexane
SMILESC=C1CC(C)CC(=C)C1C
InChIInChI=1S/C10H16/c1-7-5-8(2)10(4)9(3)6-7/h7,10H,2-3,5-6H2,1,4H3
InChIKeyRPYZTXQRXYITKQ-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.16
Rot. Bonds

About 2,5-dimethyl-1,3-dimethylidenecyclohexane

2,5-dimethyl-1,3-dimethylidenecyclohexane (PubChem CID 140827340) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 2,5-dimethyl-1,3-dimethylidenecyclohexane.

Molecular Properties

Compound Name2,5-dimethyl-1,3-dimethylidenecyclohexane
PubChem CID140827340
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name2,5-dimethyl-1,3-dimethylidenecyclohexane
SMILESC=C1CC(C)CC(=C)C1C
InChIInChI=1S/C10H16/c1-7-5-8(2)10(4)9(3)6-7/h7,10H,2-3,5-6H2,1,4H3
InChIKeyRPYZTXQRXYITKQ-UHFFFAOYSA-N
XLogP3.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.16
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

2,4-Dimethyl-1-heptene
CID 123385
Cyclohexane, 1-methylene-4-(1-methylethenyl)-
CID 68140
2,4-Dimethyl-1-hexene
CID 519301
1-Methyl-4-methylidenecyclohexane
CID 520363
1-Methyl-4-(1-methylethenyl)cyclohexane
CID 14299
Hexane, 3-methyl-4-methylene-
CID 103004
3-Ethyl-2-methyl-1-heptene
CID 140588
p-Menth-1(7)-ene
CID 517973
(Prop-1-en-2-yl)cyclohexane
CID 523966
2,3-Dimethylhex-1-ene
CID 86061
1-Methyl-2-methylenecyclohexane
CID 137725
1-Ethyl-4-methylidenecyclohexane
CID 57602807

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1,3-dimethylidenecyclohexane?
The IUPAC name of 2,5-dimethyl-1,3-dimethylidenecyclohexane (CID 140827340) is 2,5-dimethyl-1,3-dimethylidenecyclohexane.
What is the SMILES notation for 2,5-dimethyl-1,3-dimethylidenecyclohexane?
The canonical SMILES for 2,5-dimethyl-1,3-dimethylidenecyclohexane is C=C1CC(C)CC(=C)C1C.
What is the InChIKey of 2,5-dimethyl-1,3-dimethylidenecyclohexane?
The InChIKey is RPYZTXQRXYITKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-7-5-8(2)10(4)9(3)6-7/h7,10H,2-3,5-6H2,1,4H3.
What are the key properties of 2,5-dimethyl-1,3-dimethylidenecyclohexane?
2,5-dimethyl-1,3-dimethylidenecyclohexane has a molecular weight of 136.24 g/mol, XLogP of 3.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1,3-dimethylidenecyclohexane is sourced from PubChem (CID 140827340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).