3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol

C12H25NO2 — CID 114502590

IUPAC3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol
SMILESCC1CN(CCOC(C)(C)C)CCC1O
InChIInChI=1S/C12H25NO2/c1-10-9-13(6-5-11(10)14)7-8-15-12(2,3)4/h10-11,14H,5-9H2,1-4H3
InChIKeyYGVCCSHWVWSFGE-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.50
Rot. Bonds3

About 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol

3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol (PubChem CID 114502590) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol.

Molecular Properties

Compound Name3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol
PubChem CID114502590
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol
SMILESCC1CN(CCOC(C)(C)C)CCC1O
InChIInChI=1S/C12H25NO2/c1-10-9-13(6-5-11(10)14)7-8-15-12(2,3)4/h10-11,14H,5-9H2,1-4H3
InChIKeyYGVCCSHWVWSFGE-UHFFFAOYSA-N
XLogP1.50
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Morpholin-4-yl)butan-2-ol
CID 14555601
1-(2-Methoxyethyl)piperidin-4-ol
CID 21353752
[1-(2-Methoxyethyl)piperidin-3-yl]methanol
CID 45791056
1,3,5-Trimethylpiperidin-4-ol
CID 91446778
1-Butyl-5-methyl-piperidine-3,4-diol
CID 44368231
1-[2-(Propan-2-yloxy)ethyl]piperidin-4-ol
CID 57637276
1-(3,5-Dimethylpiperidin-1-yl)-3-(tert-pentyloxy)propan-2-ol hydrochloride
CID 16958190
1-Butoxy-3-(3,5-dimethylpiperidin-1-yl)propan-2-ol hydrochloride
CID 16958271
1-Butoxy-3-(3,5-dimethylpiperidin-1-yl)propan-2-ol
CID 16958272
1-(Tert-butoxy)-3-(3,5-dimethylpiperidin-1-yl)propan-2-ol hydrochloride
CID 18593245
1-(Tert-butoxy)-3-(4-methylpiperidin-1-yl)propan-2-ol hydrochloride
CID 18593246
1-(3-Methyl-1-piperidyl)-3-(tert-pentyloxy)-2-propanol
CID 44117052

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol?
The IUPAC name of 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol (CID 114502590) is 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol.
What is the SMILES notation for 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol?
The canonical SMILES for 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol is CC1CN(CCOC(C)(C)C)CCC1O.
What is the InChIKey of 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol?
The InChIKey is YGVCCSHWVWSFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-10-9-13(6-5-11(10)14)7-8-15-12(2,3)4/h10-11,14H,5-9H2,1-4H3.
What are the key properties of 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol?
3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol has a molecular weight of 215.34 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol is sourced from PubChem (CID 114502590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).