1,5-dimethoxy-2,3-dimethylidenecyclohexane

C10H16O2 — CID 20632849

IUPAC1,5-dimethoxy-2,3-dimethylidenecyclohexane
SMILESC=C1CC(OC)CC(OC)C1=C
InChIInChI=1S/C10H16O2/c1-7-5-9(11-3)6-10(12-4)8(7)2/h9-10H,1-2,5-6H2,3-4H3
InChIKeyNODMFOWMSRRHIT-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.92
Rot. Bonds2

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

1,5-dimethoxy-2,3-dimethylidenecyclohexane (PubChem CID 20632849) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 1,5-dimethoxy-2,3-dimethylidenecyclohexane.

Molecular Properties

Compound Name1,5-dimethoxy-2,3-dimethylidenecyclohexane
PubChem CID20632849
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name1,5-dimethoxy-2,3-dimethylidenecyclohexane
SMILESC=C1CC(OC)CC(OC)C1=C
InChIInChI=1S/C10H16O2/c1-7-5-9(11-3)6-10(12-4)8(7)2/h9-10H,1-2,5-6H2,3-4H3
InChIKeyNODMFOWMSRRHIT-UHFFFAOYSA-N
XLogP1.92
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Dimethoxy-5-methylidenecyclohexane
CID 15710807
1-Ethenylidene-3-ethoxy-2-methylidenecyclohexane
CID 20689741
1,3-Dimethoxy-2-methylidenecyclohexane
CID 90969283
3,5-Dimethoxy-2-methylidenecyclohexan-1-ol
CID 91158347
1,3-Diethoxy-2-methylidenecyclohexane
CID 91306145
2,4-Dimethoxy-1-methylidenecyclohexane
CID 91329046
1,2,3-Trimethoxy-5-methylidenecyclohexane
CID 91345450
3-Methoxy-4-methylidenecyclohexan-1-ol
CID 91352795
1-Ethoxy-3-methoxy-2-methylidenecyclohexane
CID 91554838
4-Methoxy-1-methylidene-2-prop-2-ynoxycyclohexane
CID 123581621
3,5-Dimethoxy-2-(methoxymethyl)-4-methylidenehepta-1,6-diene
CID 123915006

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethoxy-2,3-dimethylidenecyclohexane?
The IUPAC name of 1,5-dimethoxy-2,3-dimethylidenecyclohexane (CID 20632849) is 1,5-dimethoxy-2,3-dimethylidenecyclohexane.
What is the SMILES notation for 1,5-dimethoxy-2,3-dimethylidenecyclohexane?
The canonical SMILES for 1,5-dimethoxy-2,3-dimethylidenecyclohexane is C=C1CC(OC)CC(OC)C1=C.
What is the InChIKey of 1,5-dimethoxy-2,3-dimethylidenecyclohexane?
The InChIKey is NODMFOWMSRRHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-7-5-9(11-3)6-10(12-4)8(7)2/h9-10H,1-2,5-6H2,3-4H3.
What are the key properties of 1,5-dimethoxy-2,3-dimethylidenecyclohexane?
1,5-dimethoxy-2,3-dimethylidenecyclohexane has a molecular weight of 168.24 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethoxy-2,3-dimethylidenecyclohexane is sourced from PubChem (CID 20632849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).