1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol

C11H20O2 — CID 103560276

IUPAC1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol
SMILESCOC1(CC(O)C2CCC2)CCC1
InChIInChI=1S/C11H20O2/c1-13-11(6-3-7-11)8-10(12)9-4-2-5-9/h9-10,12H,2-8H2,1H3
InChIKeyZYELWQLVWITSNR-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.11
Rot. Bonds4

About 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol

1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol (PubChem CID 103560276) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol.

Molecular Properties

Compound Name1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol
PubChem CID103560276
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol
SMILESCOC1(CC(O)C2CCC2)CCC1
InChIInChI=1S/C11H20O2/c1-13-11(6-3-7-11)8-10(12)9-4-2-5-9/h9-10,12H,2-8H2,1H3
InChIKeyZYELWQLVWITSNR-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol?
The IUPAC name of 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol (CID 103560276) is 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol.
What is the SMILES notation for 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol?
The canonical SMILES for 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol is COC1(CC(O)C2CCC2)CCC1.
What is the InChIKey of 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol?
The InChIKey is ZYELWQLVWITSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-13-11(6-3-7-11)8-10(12)9-4-2-5-9/h9-10,12H,2-8H2,1H3.
What are the key properties of 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol?
1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol has a molecular weight of 184.28 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-(1-methoxycyclobutyl)ethanol is sourced from PubChem (CID 103560276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).