[1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol

C16H25NO2 — CID 2842706

IUPAC[1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol
SMILESCOc1cc(C)c(CN2CCCCC2CO)cc1C
InChIInChI=1S/C16H25NO2/c1-12-9-16(19-3)13(2)8-14(12)10-17-7-5-4-6-15(17)11-18/h8-9,15,18H,4-7,10-11H2,1-3H3
InChIKeyKDZAROCPKYHUQS-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.66
Rot. Bonds4

About [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol

[1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol (PubChem CID 2842706) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol
PubChem CID2842706
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name[1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol
SMILESCOc1cc(C)c(CN2CCCCC2CO)cc1C
InChIInChI=1S/C16H25NO2/c1-12-9-16(19-3)13(2)8-14(12)10-17-7-5-4-6-15(17)11-18/h8-9,15,18H,4-7,10-11H2,1-3H3
InChIKeyKDZAROCPKYHUQS-UHFFFAOYSA-N
XLogP2.66
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 ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol 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-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol?
The IUPAC name of [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol (CID 2842706) is [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol.
What is the SMILES notation for [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol?
The canonical SMILES for [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol is COc1cc(C)c(CN2CCCCC2CO)cc1C.
What is the InChIKey of [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol?
The InChIKey is KDZAROCPKYHUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-12-9-16(19-3)13(2)8-14(12)10-17-7-5-4-6-15(17)11-18/h8-9,15,18H,4-7,10-11H2,1-3H3.
What are the key properties of [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol?
[1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol has a molecular weight of 263.38 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-methoxy-2,5-dimethylphenyl)methyl]piperidin-2-yl]methanol is sourced from PubChem (CID 2842706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).