1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol

C16H25NO2 — CID 82486099

IUPAC1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol
SMILESCOc1c(C)cc(C)cc1CCN1CCC(O)CC1
InChIInChI=1S/C16H25NO2/c1-12-10-13(2)16(19-3)14(11-12)4-7-17-8-5-15(18)6-9-17/h10-11,15,18H,4-9H2,1-3H3
InChIKeyLHWOSJSQWUEJNW-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.31
Rot. Bonds4

About 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol

1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol (PubChem CID 82486099) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol
PubChem CID82486099
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol
SMILESCOc1c(C)cc(C)cc1CCN1CCC(O)CC1
InChIInChI=1S/C16H25NO2/c1-12-10-13(2)16(19-3)14(11-12)4-7-17-8-5-15(18)6-9-17/h10-11,15,18H,4-9H2,1-3H3
InChIKeyLHWOSJSQWUEJNW-UHFFFAOYSA-N
XLogP2.31
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 ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(2,4,6-trimethylphenyl)propyl]piperidin-4-ol
CID 82485339
3-(4-hydroxypiperidin-1-yl)-1-(2,4,6-trimethylphenyl)propan-1-one
CID 98019521
1-[2-(3,4-dimethylphenyl)ethyl]piperidin-4-ol
CID 82475686
2-(2-methoxy-3,5-dimethylphenyl)-1-(4-methylpiperazin-1-yl)ethanone
CID 110769302
1-[(2-methoxy-5-methylphenyl)methyl]piperidin-4-ol
CID 47010589
(2S)-1-[(2-methoxy-3,5-dimethylphenyl)methyl]azetidine-2-carboxylic acid
CID 99937830
1-[2-(3-methoxyphenyl)ethyl]piperidin-4-ol
CID 82083424
[1-[[(3R,4R)-4-(hydroxymethyl)-1-[(2-methoxy-3,5-dimethylphenyl)methyl]pyrrolidin-3-yl]methyl]piperidin-4-yl]methanol
CID 72904268
1-[(2-methoxy-3,5-dimethylphenyl)methyl]piperidine-3-carboxylic acid
CID 5235973
4-(2-methoxy-3,5-dimethylphenyl)butan-1-amine
CID 82255348
1-but-3-ynyl-2-methoxy-3,5-dimethylbenzene
CID 83941962
N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine
CID 115118462

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol?
The IUPAC name of 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol (CID 82486099) is 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol?
The canonical SMILES for 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol is COc1c(C)cc(C)cc1CCN1CCC(O)CC1.
What is the InChIKey of 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol?
The InChIKey is LHWOSJSQWUEJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-12-10-13(2)16(19-3)14(11-12)4-7-17-8-5-15(18)6-9-17/h10-11,15,18H,4-9H2,1-3H3.
What are the key properties of 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol?
1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol has a molecular weight of 263.38 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-ol is sourced from PubChem (CID 82486099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).