4-ethyl-1,3-dimethoxy-6-methylcyclohexene

C11H20O2 — CID 163495320

IUPAC4-ethyl-1,3-dimethoxy-6-methylcyclohexene
SMILESCCC1CC(C)C(OC)=CC1OC
InChIInChI=1S/C11H20O2/c1-5-9-6-8(2)10(12-3)7-11(9)13-4/h7-9,11H,5-6H2,1-4H3
InChIKeyCQEOXJMMZMKKEM-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.60
Rot. Bonds3

About 4-ethyl-1,3-dimethoxy-6-methylcyclohexene

4-ethyl-1,3-dimethoxy-6-methylcyclohexene (PubChem CID 163495320) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 4-ethyl-1,3-dimethoxy-6-methylcyclohexene.

Molecular Properties

Compound Name4-ethyl-1,3-dimethoxy-6-methylcyclohexene
PubChem CID163495320
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name4-ethyl-1,3-dimethoxy-6-methylcyclohexene
SMILESCCC1CC(C)C(OC)=CC1OC
InChIInChI=1S/C11H20O2/c1-5-9-6-8(2)10(12-3)7-11(9)13-4/h7-9,11H,5-6H2,1-4H3
InChIKeyCQEOXJMMZMKKEM-UHFFFAOYSA-N
XLogP2.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R,4R)-4-methoxy-2-[(2S)-1-(methoxymethoxy)propan-2-yl]-3,6-dimethyl-3,4-dihydro-2H-pyran
CID 23635075
1,3-Diethoxy-5,5-dimethylcyclohexene
CID 10899609
[3-(2-Methylpropoxy)-5-propan-2-yloxycyclohex-3-en-1-yl]methanol
CID 67489408
(3Z)-3-(2-methoxyethylidene)-2,4-dimethyloxane
CID 67559536
1,4-Dimethyl-3-prop-1-en-2-yloxycyclohexene
CID 68097134
1,5-Bis(methoxymethyl)cyclohexene
CID 68340970
[(6R)-3-acetyloxy-6-propan-2-ylcyclohex-2-en-1-yl] acetate
CID 71050625
1,3-Dimethoxycyclohexene
CID 85914585
1,3-Dimethoxy-5-methylcyclohexene
CID 123659997
2-methyl-4-(2H-pyran-2-yl)butan-1-ol
CID 140031693
1,3-Dipropoxycyclohexene
CID 141951114
1,2,3-Trimethoxy-3-propan-2-yloxy-5-prop-2-enylcyclohexene
CID 145001992

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,3-dimethoxy-6-methylcyclohexene?
The IUPAC name of 4-ethyl-1,3-dimethoxy-6-methylcyclohexene (CID 163495320) is 4-ethyl-1,3-dimethoxy-6-methylcyclohexene.
What is the SMILES notation for 4-ethyl-1,3-dimethoxy-6-methylcyclohexene?
The canonical SMILES for 4-ethyl-1,3-dimethoxy-6-methylcyclohexene is CCC1CC(C)C(OC)=CC1OC.
What is the InChIKey of 4-ethyl-1,3-dimethoxy-6-methylcyclohexene?
The InChIKey is CQEOXJMMZMKKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-5-9-6-8(2)10(12-3)7-11(9)13-4/h7-9,11H,5-6H2,1-4H3.
What are the key properties of 4-ethyl-1,3-dimethoxy-6-methylcyclohexene?
4-ethyl-1,3-dimethoxy-6-methylcyclohexene has a molecular weight of 184.28 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,3-dimethoxy-6-methylcyclohexene is sourced from PubChem (CID 163495320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).