1-(2-methoxypropyl)-3-methylpiperidin-4-ol

C10H21NO2 — CID 114502642

IUPAC1-(2-methoxypropyl)-3-methylpiperidin-4-ol
SMILESCOC(C)CN1CCC(O)C(C)C1
InChIInChI=1S/C10H21NO2/c1-8-6-11(5-4-10(8)12)7-9(2)13-3/h8-10,12H,4-7H2,1-3H3
InChIKeyRMBQMCKYOLCVJG-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.72
Rot. Bonds3

About 1-(2-methoxypropyl)-3-methylpiperidin-4-ol

1-(2-methoxypropyl)-3-methylpiperidin-4-ol (PubChem CID 114502642) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-(2-methoxypropyl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(2-methoxypropyl)-3-methylpiperidin-4-ol
PubChem CID114502642
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-(2-methoxypropyl)-3-methylpiperidin-4-ol
SMILESCOC(C)CN1CCC(O)C(C)C1
InChIInChI=1S/C10H21NO2/c1-8-6-11(5-4-10(8)12)7-9(2)13-3/h8-10,12H,4-7H2,1-3H3
InChIKeyRMBQMCKYOLCVJG-UHFFFAOYSA-N
XLogP0.72
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxypropyl)-3-methylpiperidin-4-ol?
The IUPAC name of 1-(2-methoxypropyl)-3-methylpiperidin-4-ol (CID 114502642) is 1-(2-methoxypropyl)-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-(2-methoxypropyl)-3-methylpiperidin-4-ol?
The canonical SMILES for 1-(2-methoxypropyl)-3-methylpiperidin-4-ol is COC(C)CN1CCC(O)C(C)C1.
What is the InChIKey of 1-(2-methoxypropyl)-3-methylpiperidin-4-ol?
The InChIKey is RMBQMCKYOLCVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8-6-11(5-4-10(8)12)7-9(2)13-3/h8-10,12H,4-7H2,1-3H3.
What are the key properties of 1-(2-methoxypropyl)-3-methylpiperidin-4-ol?
1-(2-methoxypropyl)-3-methylpiperidin-4-ol has a molecular weight of 187.28 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxypropyl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 114502642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).