3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol

C12H25NO2 — CID 62270202

IUPAC3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol
SMILESCC(C)(CO)CN1CCCCC1CCO
InChIInChI=1S/C12H25NO2/c1-12(2,10-15)9-13-7-4-3-5-11(13)6-8-14/h11,14-15H,3-10H2,1-2H3
InChIKeyISSJFJVGVOMVQC-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.24
Rot. Bonds5

About 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol

3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol (PubChem CID 62270202) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol.

Molecular Properties

Compound Name3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol
PubChem CID62270202
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol
SMILESCC(C)(CO)CN1CCCCC1CCO
InChIInChI=1S/C12H25NO2/c1-12(2,10-15)9-13-7-4-3-5-11(13)6-8-14/h11,14-15H,3-10H2,1-2H3
InChIKeyISSJFJVGVOMVQC-UHFFFAOYSA-N
XLogP1.24
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-ethylpiperidin-1-yl)-2,2-dimethylpropan-1-ol
CID 62271835
2-[1-[3-(tert-butylamino)-2,2-dimethylpropyl]piperidin-2-yl]ethanol
CID 55051425
1-[2-(2-hydroxyethyl)piperidin-1-yl]-2-methylbutan-2-ol
CID 114495321
3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropanal
CID 62276374
2-[1-(3-amino-2,2-dimethylbutyl)piperidin-2-yl]ethanol
CID 66454911
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884
2-[1-[2-(aminomethyl)-2-methylbutyl]piperidin-2-yl]ethanol
CID 62262685
methyl 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropanoate
CID 79624536
4-[2-(2-hydroxyethyl)piperidin-1-yl]-2-methylbutan-2-ol
CID 79361314
2-[1-(2-methylpropyl)piperidin-2-yl]ethanol
CID 62021194
2,2-dimethyl-3-(2-propylpiperidin-1-yl)propan-1-amine
CID 83056263
2-[1-[2-methyl-2-[(propan-2-ylamino)methyl]pentyl]piperidin-2-yl]ethanol
CID 62261558

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol?
The IUPAC name of 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol (CID 62270202) is 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol.
What is the SMILES notation for 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol?
The canonical SMILES for 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol is CC(C)(CO)CN1CCCCC1CCO.
What is the InChIKey of 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol?
The InChIKey is ISSJFJVGVOMVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-12(2,10-15)9-13-7-4-3-5-11(13)6-8-14/h11,14-15H,3-10H2,1-2H3.
What are the key properties of 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol?
3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol has a molecular weight of 215.34 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-hydroxyethyl)piperidin-1-yl]-2,2-dimethylpropan-1-ol is sourced from PubChem (CID 62270202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).