1-ethyl-1-methoxycyclohexane

C9H18O — CID 21039859

IUPAC1-ethyl-1-methoxycyclohexane
SMILESCCC1(OC)CCCCC1
InChIInChI=1S/C9H18O/c1-3-9(10-2)7-5-4-6-8-9/h3-8H2,1-2H3
InChIKeySKSDXUABSDSRSZ-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.75
Rot. Bonds2

About 1-ethyl-1-methoxycyclohexane

1-ethyl-1-methoxycyclohexane (PubChem CID 21039859) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is 1-ethyl-1-methoxycyclohexane.

Molecular Properties

Compound Name1-ethyl-1-methoxycyclohexane
PubChem CID21039859
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name1-ethyl-1-methoxycyclohexane
SMILESCCC1(OC)CCCCC1
InChIInChI=1S/C9H18O/c1-3-9(10-2)7-5-4-6-8-9/h3-8H2,1-2H3
InChIKeySKSDXUABSDSRSZ-UHFFFAOYSA-N
XLogP2.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(bromomethyl)-1-methoxycycloheptane
CID 62113509
(1-methoxycyclooctyl)methanol
CID 165494656
3-ethyl-3-methoxy-1-methylazepane
CID 24974913
1-ethyl-4,4-difluoro-1-methoxycyclohexane
CID 121407300
2-(1-methoxycycloheptyl)ethanamine
CID 83905895
(1-ethylcyclohexyl) methyl carbonate
CID 59539840
1-methoxy-1-propylcyclobutane
CID 118668756
1,3-diethyl-3-methoxypiperidine
CID 153193773
1-(1-methoxycyclopentyl)-N-methylmethanamine
CID 62106218
(1-methoxycyclohexyl)methanesulfonamide
CID 131186704
(1-ethylcyclopentyl) methyl carbonate
CID 59539839
bis(1-ethylcyclopentyl) sulfite
CID 87154508

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-methoxycyclohexane?
The IUPAC name of 1-ethyl-1-methoxycyclohexane (CID 21039859) is 1-ethyl-1-methoxycyclohexane.
What is the SMILES notation for 1-ethyl-1-methoxycyclohexane?
The canonical SMILES for 1-ethyl-1-methoxycyclohexane is CCC1(OC)CCCCC1.
What is the InChIKey of 1-ethyl-1-methoxycyclohexane?
The InChIKey is SKSDXUABSDSRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O/c1-3-9(10-2)7-5-4-6-8-9/h3-8H2,1-2H3.
What are the key properties of 1-ethyl-1-methoxycyclohexane?
1-ethyl-1-methoxycyclohexane has a molecular weight of 142.24 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-methoxycyclohexane is sourced from PubChem (CID 21039859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).