3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol

C11H21NO2 — CID 106823711

IUPAC3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol
SMILESCOC1CC(O)(C2CC(C)CCN2)C1
InChIInChI=1S/C11H21NO2/c1-8-3-4-12-10(5-8)11(13)6-9(7-11)14-2/h8-10,12-13H,3-7H2,1-2H3
InChIKeyRAQGUCANBZXNCH-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.91
Rot. Bonds2

About 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol

3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol (PubChem CID 106823711) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol
PubChem CID106823711
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol
SMILESCOC1CC(O)(C2CC(C)CCN2)C1
InChIInChI=1S/C11H21NO2/c1-8-3-4-12-10(5-8)11(13)6-9(7-11)14-2/h8-10,12-13H,3-7H2,1-2H3
InChIKeyRAQGUCANBZXNCH-UHFFFAOYSA-N
XLogP0.91
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol?
The IUPAC name of 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol (CID 106823711) is 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol.
What is the SMILES notation for 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol?
The canonical SMILES for 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol is COC1CC(O)(C2CC(C)CCN2)C1.
What is the InChIKey of 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol?
The InChIKey is RAQGUCANBZXNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-8-3-4-12-10(5-8)11(13)6-9(7-11)14-2/h8-10,12-13H,3-7H2,1-2H3.
What are the key properties of 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol?
3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol has a molecular weight of 199.29 g/mol, XLogP of 0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(4-methylpiperidin-2-yl)cyclobutan-1-ol is sourced from PubChem (CID 106823711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).