1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol

C12H25NO2 — CID 63929421

IUPAC1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol
SMILESCCCC1CCN(CC(O)COC)CC1
InChIInChI=1S/C12H25NO2/c1-3-4-11-5-7-13(8-6-11)9-12(14)10-15-2/h11-12,14H,3-10H2,1-2H3
InChIKeyXOFKRFWCXZWVAC-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.51
Rot. Bonds6

About 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol

1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol (PubChem CID 63929421) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol
PubChem CID63929421
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol
SMILESCCCC1CCN(CC(O)COC)CC1
InChIInChI=1S/C12H25NO2/c1-3-4-11-5-7-13(8-6-11)9-12(14)10-15-2/h11-12,14H,3-10H2,1-2H3
InChIKeyXOFKRFWCXZWVAC-UHFFFAOYSA-N
XLogP1.51
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol?
The IUPAC name of 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol (CID 63929421) is 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol.
What is the SMILES notation for 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol?
The canonical SMILES for 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol is CCCC1CCN(CC(O)COC)CC1.
What is the InChIKey of 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol?
The InChIKey is XOFKRFWCXZWVAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-3-4-11-5-7-13(8-6-11)9-12(14)10-15-2/h11-12,14H,3-10H2,1-2H3.
What are the key properties of 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol?
1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol has a molecular weight of 215.34 g/mol, XLogP of 1.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-(4-propylpiperidin-1-yl)propan-2-ol is sourced from PubChem (CID 63929421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).