(2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol

C15H23NO2 — CID 82341661

IUPAC(2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol
SMILESCOc1c(C)cc(C)cc1C(O)C1CCCCN1
InChIInChI=1S/C15H23NO2/c1-10-8-11(2)15(18-3)12(9-10)14(17)13-6-4-5-7-16-13/h8-9,13-14,16-17H,4-7H2,1-3H3
InChIKeyVTAXXIRACIOGRD-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.49
Rot. Bonds3

About (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol

(2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol (PubChem CID 82341661) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol.

Molecular Properties

Compound Name(2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol
PubChem CID82341661
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol
SMILESCOc1c(C)cc(C)cc1C(O)C1CCCCN1
InChIInChI=1S/C15H23NO2/c1-10-8-11(2)15(18-3)12(9-10)14(17)13-6-4-5-7-16-13/h8-9,13-14,16-17H,4-7H2,1-3H3
InChIKeyVTAXXIRACIOGRD-UHFFFAOYSA-N
XLogP2.49
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-3,5-dimethylphenyl)-N-methyl-1-pyrrolidin-2-ylmethanamine
CID 116950924
(2-methoxy-5-methylphenyl)-pyrrolidin-2-ylmethanol
CID 64866825
(2,3,4,5,6-pentamethylphenyl)-piperidin-2-ylmethanol
CID 64866585
2-(cyclohexylamino)-1-(2-methoxy-3,5-dimethylphenyl)ethanol
CID 82315590
2-[pyrrolidin-2-yl-(2,4,6-trimethylphenyl)methyl]pyrrolidine
CID 170905811
[2-methyl-4-(trifluoromethyl)phenyl]-piperidin-2-ylmethanol
CID 106634718
azepan-2-yl-(2-methylquinolin-4-yl)methanol
CID 79235774
(4-methoxy-2,3,6-trimethylphenyl)-piperidin-2-ylmethanamine
CID 116935748
1-(4-methoxy-2,3,5-trimethylphenyl)-N-methyl-1-pyrrolidin-2-ylmethanamine
CID 116950925
(S)-[2-(4-methoxyphenyl)quinolin-4-yl]-[(2R)-piperidin-2-yl]methanol
CID 53298715
(2-methylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 164654197
N-[(2-methoxy-3,5-dimethylphenyl)methyl]-1-pyrrolidin-2-ylmethanamine
CID 115208267

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol?
The IUPAC name of (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol (CID 82341661) is (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol.
What is the SMILES notation for (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol?
The canonical SMILES for (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol is COc1c(C)cc(C)cc1C(O)C1CCCCN1.
What is the InChIKey of (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol?
The InChIKey is VTAXXIRACIOGRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-10-8-11(2)15(18-3)12(9-10)14(17)13-6-4-5-7-16-13/h8-9,13-14,16-17H,4-7H2,1-3H3.
What are the key properties of (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol?
(2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol has a molecular weight of 249.35 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-3,5-dimethylphenyl)-piperidin-2-ylmethanol is sourced from PubChem (CID 82341661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).