2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol

C18H29NO2 — CID 82216974

IUPAC2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol
SMILESCCC1CCCCN1CC(O)c1c(C)cc(OC)cc1C
InChIInChI=1S/C18H29NO2/c1-5-15-8-6-7-9-19(15)12-17(20)18-13(2)10-16(21-4)11-14(18)3/h10-11,15,17,20H,5-9,12H2,1-4H3
InChIKeySOLXEJPBSQADAF-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.61
Rot. Bonds5

About 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol

2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol (PubChem CID 82216974) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol
PubChem CID82216974
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol
SMILESCCC1CCCCN1CC(O)c1c(C)cc(OC)cc1C
InChIInChI=1S/C18H29NO2/c1-5-15-8-6-7-9-19(15)12-17(20)18-13(2)10-16(21-4)11-14(18)3/h10-11,15,17,20H,5-9,12H2,1-4H3
InChIKeySOLXEJPBSQADAF-UHFFFAOYSA-N
XLogP3.61
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methoxy-2,6-dimethylphenyl)-2-piperidin-1-ylethanol
CID 82216996
1-(3-amino-4-methylphenyl)-2-(2-ethylpiperidin-1-yl)ethanol
CID 82071378
1-(2,4-dimethoxyphenyl)-3-(2-ethylpiperidin-1-yl)propan-1-ol
CID 82074086
1-[2-chloro-2-(2-methoxy-5-methylphenyl)ethyl]-2-ethylpiperidine
CID 82214719
2-(2-ethylazepan-1-yl)-1-(4-propylphenyl)ethanol
CID 104691439
2-(2-ethylpiperidin-1-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 43266464
2-[2-(3,5-dimethoxyphenyl)-2-hydroxyethyl]-1-ethyl-3-[2-(2-ethylpiperidin-1-yl)ethyl]guanidine
CID 111983207
1-(3,4-dimethylphenyl)-3-(2-ethylpiperidin-1-yl)propan-1-ol
CID 82073504
(1S)-2-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]-1-(4-methoxyphenyl)ethanol
CID 10801648
1-chloro-3-(2-ethylazepan-1-yl)propan-2-ol
CID 104691333
methyl 2-bromo-3-(2-ethylpiperidin-1-yl)propanoate
CID 81100236
methyl 3-[(2S)-3-[(2R)-2-ethylpiperidin-1-yl]-2-hydroxypropoxy]benzoate
CID 7998324

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol?
The IUPAC name of 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol (CID 82216974) is 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol.
What is the SMILES notation for 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol?
The canonical SMILES for 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol is CCC1CCCCN1CC(O)c1c(C)cc(OC)cc1C.
What is the InChIKey of 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol?
The InChIKey is SOLXEJPBSQADAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-5-15-8-6-7-9-19(15)12-17(20)18-13(2)10-16(21-4)11-14(18)3/h10-11,15,17,20H,5-9,12H2,1-4H3.
What are the key properties of 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol?
2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol has a molecular weight of 291.44 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpiperidin-1-yl)-1-(4-methoxy-2,6-dimethylphenyl)ethanol is sourced from PubChem (CID 82216974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).