4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol

C16H25NO2 — CID 55120385

IUPAC4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol
SMILESCCCN1CCC(O)(c2cc(C)ccc2OC)CC1
InChIInChI=1S/C16H25NO2/c1-4-9-17-10-7-16(18,8-11-17)14-12-13(2)5-6-15(14)19-3/h5-6,12,18H,4,7-11H2,1-3H3
InChIKeyOTSWTECWQRPSSR-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.70
Rot. Bonds4

About 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol

4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol (PubChem CID 55120385) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol.

Molecular Properties

Compound Name4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol
PubChem CID55120385
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol
SMILESCCCN1CCC(O)(c2cc(C)ccc2OC)CC1
InChIInChI=1S/C16H25NO2/c1-4-9-17-10-7-16(18,8-11-17)14-12-13(2)5-6-15(14)19-3/h5-6,12,18H,4,7-11H2,1-3H3
InChIKeyOTSWTECWQRPSSR-UHFFFAOYSA-N
XLogP2.70
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-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 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol?
The IUPAC name of 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol (CID 55120385) is 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol.
What is the SMILES notation for 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol?
The canonical SMILES for 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol is CCCN1CCC(O)(c2cc(C)ccc2OC)CC1.
What is the InChIKey of 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol?
The InChIKey is OTSWTECWQRPSSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-9-17-10-7-16(18,8-11-17)14-12-13(2)5-6-15(14)19-3/h5-6,12,18H,4,7-11H2,1-3H3.
What are the key properties of 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol?
4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol has a molecular weight of 263.38 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol is sourced from PubChem (CID 55120385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).