ethane;1-methoxy-4-propan-2-ylcyclohexane

C12H26O — CID 178120184

IUPACethane;1-methoxy-4-propan-2-ylcyclohexane
SMILESCC.COC1CCC(C(C)C)CC1
InChIInChI=1S/C10H20O.C2H6/c1-8(2)9-4-6-10(11-3)7-5-9;1-2/h8-10H,4-7H2,1-3H3;1-2H3
InChIKeyRSFIUVYECLLAFY-UHFFFAOYSA-N
MW186.34 g/mol
LogP3.87
Rot. Bonds2

About ethane;1-methoxy-4-propan-2-ylcyclohexane

ethane;1-methoxy-4-propan-2-ylcyclohexane (PubChem CID 178120184) has the molecular formula C12H26O and a molecular weight of 186.34 g/mol. Its IUPAC name is ethane;1-methoxy-4-propan-2-ylcyclohexane.

Molecular Properties

Compound Nameethane;1-methoxy-4-propan-2-ylcyclohexane
PubChem CID178120184
Molecular FormulaC12H26O
Molecular Weight186.34 g/mol
Exact Mass186.20
IUPAC Nameethane;1-methoxy-4-propan-2-ylcyclohexane
SMILESCC.COC1CCC(C(C)C)CC1
InChIInChI=1S/C10H20O.C2H6/c1-8(2)9-4-6-10(11-3)7-5-9;1-2/h8-10H,4-7H2,1-3H3;1-2H3
InChIKeyRSFIUVYECLLAFY-UHFFFAOYSA-N
XLogP3.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-propan-2-yl-4-propan-2-yloxycyclohexane
CID 18386923
1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane
CID 154964440
2-(4-methoxycyclohexyl)propanal
CID 173023643
propan-2-ylcyclopropane;hydroiodide
CID 162314014
2-methoxy-5-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 155006906
(2R)-2-amino-2-(4-methoxycyclohexyl)acetaldehyde
CID 168758856
N-(dicyclopropylmethyl)-3-methoxycyclopentan-1-amine
CID 103082890
1,3-dimethoxy-2-methylpropane;ethane;1-methoxy-4-methylcyclohexane
CID 143819312
cis-(1S,3R)-1,3-dimethoxycyclopentane
CID 22214084
cis-(1S,3R)-1-methyl-3-propan-2-ylcyclopentane;ethane;hydrofluoride
CID 169140803
ethane-1,2-diol;methoxycyclopropane
CID 174681664
(4-methoxycyclohexyl)phosphane
CID 89371485

Frequently Asked Questions

What is the IUPAC name of ethane;1-methoxy-4-propan-2-ylcyclohexane?
The IUPAC name of ethane;1-methoxy-4-propan-2-ylcyclohexane (CID 178120184) is ethane;1-methoxy-4-propan-2-ylcyclohexane.
What is the SMILES notation for ethane;1-methoxy-4-propan-2-ylcyclohexane?
The canonical SMILES for ethane;1-methoxy-4-propan-2-ylcyclohexane is CC.COC1CCC(C(C)C)CC1.
What is the InChIKey of ethane;1-methoxy-4-propan-2-ylcyclohexane?
The InChIKey is RSFIUVYECLLAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O.C2H6/c1-8(2)9-4-6-10(11-3)7-5-9;1-2/h8-10H,4-7H2,1-3H3;1-2H3.
What are the key properties of ethane;1-methoxy-4-propan-2-ylcyclohexane?
ethane;1-methoxy-4-propan-2-ylcyclohexane has a molecular weight of 186.34 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methoxy-4-propan-2-ylcyclohexane is sourced from PubChem (CID 178120184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).