2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol

C16H25NO2 — CID 117021351

IUPAC2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol
SMILESCOc1ccccc1N1CC(CCO)CCC1(C)C
InChIInChI=1S/C16H25NO2/c1-16(2)10-8-13(9-11-18)12-17(16)14-6-4-5-7-15(14)19-3/h4-7,13,18H,8-12H2,1-3H3
InChIKeyUGGJJOUGHLJFHQ-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.07
Rot. Bonds4

About 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol

2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol (PubChem CID 117021351) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol
PubChem CID117021351
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol
SMILESCOc1ccccc1N1CC(CCO)CCC1(C)C
InChIInChI=1S/C16H25NO2/c1-16(2)10-8-13(9-11-18)12-17(16)14-6-4-5-7-15(14)19-3/h4-7,13,18H,8-12H2,1-3H3
InChIKeyUGGJJOUGHLJFHQ-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2-ethoxyphenyl)-6,6-dimethylpiperidin-3-yl]methanamine
CID 117021543
2-(1-benzyl-6,6-dimethylpiperidin-3-yl)ethanol
CID 117021321
5-(2-hydroxyethyl)-3-(2-methoxyphenyl)-1,3-oxazinan-2-one
CID 117011181
2-[1-(2-ethoxyphenyl)pyrrolidin-3-yl]ethanol
CID 117028471
1-(2-ethoxyphenyl)-6,6-dimethylpiperidine-3-carbonitrile
CID 117021196
2-[1-(2-methoxyphenyl)-2,2-dimethylpyrrolidin-3-yl]acetic acid
CID 117017371
1-(2-tert-butylphenyl)-6,6-dimethylpiperidin-3-ol
CID 117020854
[1-(2-chlorophenyl)-5,5-dimethylpyrrolidin-3-yl]methanol
CID 117018867
1-(2-chlorophenyl)-6,6-dimethylpiperidin-3-amine
CID 117021020
2-[[1-(2-methoxyphenyl)piperidin-4-yl]amino]ethanol
CID 166899340
[1-(2-methoxyphenyl)-2,2-dimethylpiperidin-3-yl]methanamine
CID 117019738
1-(2-ethoxyphenyl)-5,5-dimethylpyrrolidin-3-ol
CID 117017964

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol?
The IUPAC name of 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol (CID 117021351) is 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol?
The canonical SMILES for 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol is COc1ccccc1N1CC(CCO)CCC1(C)C.
What is the InChIKey of 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol?
The InChIKey is UGGJJOUGHLJFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-16(2)10-8-13(9-11-18)12-17(16)14-6-4-5-7-15(14)19-3/h4-7,13,18H,8-12H2,1-3H3.
What are the key properties of 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol?
2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol has a molecular weight of 263.38 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyphenyl)-6,6-dimethylpiperidin-3-yl]ethanol is sourced from PubChem (CID 117021351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).