1-cyclobutyl-3-methoxycyclohexan-1-ol

C11H20O2 — CID 106873805

IUPAC1-cyclobutyl-3-methoxycyclohexan-1-ol
SMILESCOC1CCCC(O)(C2CCC2)C1
InChIInChI=1S/C11H20O2/c1-13-10-6-3-7-11(12,8-10)9-4-2-5-9/h9-10,12H,2-8H2,1H3
InChIKeyKOVMZIWXYDUZQA-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.11
Rot. Bonds2

About 1-cyclobutyl-3-methoxycyclohexan-1-ol

1-cyclobutyl-3-methoxycyclohexan-1-ol (PubChem CID 106873805) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-cyclobutyl-3-methoxycyclohexan-1-ol.

Molecular Properties

Compound Name1-cyclobutyl-3-methoxycyclohexan-1-ol
PubChem CID106873805
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-cyclobutyl-3-methoxycyclohexan-1-ol
SMILESCOC1CCCC(O)(C2CCC2)C1
InChIInChI=1S/C11H20O2/c1-13-10-6-3-7-11(12,8-10)9-4-2-5-9/h9-10,12H,2-8H2,1H3
InChIKeyKOVMZIWXYDUZQA-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3aS)-1,2,3,4,5,6,7,7a-octahydroinden-3a-ol
CID 102059632
3-methoxycyclohexane-1,1-dicarboxylic acid
CID 18968479
3-methoxy-1-(1,2,3,4-tetrahydroisoquinolin-1-yl)cyclohexan-1-ol
CID 106873973
diethyl 2-(1-hydroxy-3-methoxycyclohexyl)propanedioate
CID 106874291
3-methoxy-1-nonylcyclohexan-1-ol
CID 106873856
4-(1-hydroxycyclopentyl)cycloheptan-1-ol
CID 173416259
1,1,3-trimethoxycycloheptane
CID 86078996
1-cyclohexyl-3-methylcyclopentan-1-ol
CID 64515969
1-(3-methoxycyclohexyl)cyclobutane-1-carboxylic acid
CID 79425629
3-methoxy-1-methyl-1-[(E)-prop-1-enyl]cyclohexane
CID 167100938
(2S,3aR,7aR)-2-methyl-1,2,3,4,5,6,7,7a-octahydroinden-3a-ol
CID 101060141
3-methoxyspiro[4.4]nonane
CID 129102731

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-methoxycyclohexan-1-ol?
The IUPAC name of 1-cyclobutyl-3-methoxycyclohexan-1-ol (CID 106873805) is 1-cyclobutyl-3-methoxycyclohexan-1-ol.
What is the SMILES notation for 1-cyclobutyl-3-methoxycyclohexan-1-ol?
The canonical SMILES for 1-cyclobutyl-3-methoxycyclohexan-1-ol is COC1CCCC(O)(C2CCC2)C1.
What is the InChIKey of 1-cyclobutyl-3-methoxycyclohexan-1-ol?
The InChIKey is KOVMZIWXYDUZQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-13-10-6-3-7-11(12,8-10)9-4-2-5-9/h9-10,12H,2-8H2,1H3.
What are the key properties of 1-cyclobutyl-3-methoxycyclohexan-1-ol?
1-cyclobutyl-3-methoxycyclohexan-1-ol has a molecular weight of 184.28 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-methoxycyclohexan-1-ol is sourced from PubChem (CID 106873805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).