2-methoxy-1,1,5-trimethylcyclohexane

C10H20O — CID 59938882

IUPAC2-methoxy-1,1,5-trimethylcyclohexane
SMILESCOC1CCC(C)CC1(C)C
InChIInChI=1S/C10H20O/c1-8-5-6-9(11-4)10(2,3)7-8/h8-9H,5-7H2,1-4H3
InChIKeyVUCWAWUUYLAEOT-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.85
Rot. Bonds1

About 2-methoxy-1,1,5-trimethylcyclohexane

2-methoxy-1,1,5-trimethylcyclohexane (PubChem CID 59938882) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-methoxy-1,1,5-trimethylcyclohexane.

Molecular Properties

Compound Name2-methoxy-1,1,5-trimethylcyclohexane
PubChem CID59938882
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-methoxy-1,1,5-trimethylcyclohexane
SMILESCOC1CCC(C)CC1(C)C
InChIInChI=1S/C10H20O/c1-8-5-6-9(11-4)10(2,3)7-8/h8-9H,5-7H2,1-4H3
InChIKeyVUCWAWUUYLAEOT-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methoxy-1,1-dimethylcyclobutane
CID 58806257
2-methoxy-1,1,4-trimethylcyclohexane
CID 70179049
2,2,4-trimethylbicyclo[5.2.0]nonane
CID 123508525
1,1,2,7-tetramethylcyclooctane
CID 141451493
1-(2,2,4-trimethylcyclohexyl)ethylsilane
CID 123412592
(1S,2R,6R,7R)-2-methoxy-1,7-dimethylbicyclo[4.1.0]heptane
CID 98172812
2,2,4,7,7-pentamethylbicyclo[6.2.0]decane
CID 148883655
1,1,2,8-tetramethylcyclononane
CID 123968014
2,2,4-trimethoxy-5,5-dimethylcyclohexan-1-ol
CID 164668290
4-methoxy-2,2,5,5-tetramethylpiperidine
CID 142471309
(1S,3aS,7aR)-1-methoxy-4,4,7a-trimethyl-2,3,3a,5,6,7-hexahydro-1H-indene
CID 90388768
(1Z)-1,2,3,3,5,8,10,10-octamethylcyclodecene
CID 143700143

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1,1,5-trimethylcyclohexane?
The IUPAC name of 2-methoxy-1,1,5-trimethylcyclohexane (CID 59938882) is 2-methoxy-1,1,5-trimethylcyclohexane.
What is the SMILES notation for 2-methoxy-1,1,5-trimethylcyclohexane?
The canonical SMILES for 2-methoxy-1,1,5-trimethylcyclohexane is COC1CCC(C)CC1(C)C.
What is the InChIKey of 2-methoxy-1,1,5-trimethylcyclohexane?
The InChIKey is VUCWAWUUYLAEOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-8-5-6-9(11-4)10(2,3)7-8/h8-9H,5-7H2,1-4H3.
What are the key properties of 2-methoxy-1,1,5-trimethylcyclohexane?
2-methoxy-1,1,5-trimethylcyclohexane has a molecular weight of 156.27 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1,1,5-trimethylcyclohexane is sourced from PubChem (CID 59938882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).