3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol

C13H25NO2 — CID 114510787

IUPAC3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol
SMILESCCC1CN(CCC2CCCO2)CCC1O
InChIInChI=1S/C13H25NO2/c1-2-11-10-14(8-6-13(11)15)7-5-12-4-3-9-16-12/h11-13,15H,2-10H2,1H3
InChIKeyXAACCSHLQFHIKX-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.65
Rot. Bonds4

About 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol

3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol (PubChem CID 114510787) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol
PubChem CID114510787
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol
SMILESCCC1CN(CCC2CCCO2)CCC1O
InChIInChI=1S/C13H25NO2/c1-2-11-10-14(8-6-13(11)15)7-5-12-4-3-9-16-12/h11-13,15H,2-10H2,1H3
InChIKeyXAACCSHLQFHIKX-UHFFFAOYSA-N
XLogP1.65
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol
CID 114502307
4-ethyl-1-(oxolan-2-ylmethyl)pyrrolidin-3-ol
CID 130871454
1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol
CID 65165900
N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine
CID 65160987
1-[2-(dimethylamino)ethyl]-3-ethylpiperidin-4-ol
CID 114511210
3-ethyl-1-heptylpiperidin-4-ol
CID 114510902
1-but-3-ynyl-3-ethylpiperidin-4-ol
CID 114511006
3-chloro-1-[2-(oxolan-2-yl)ethyl]piperidine
CID 65165784
3-[(3R,4S)-3-ethyl-4-hydroxypiperidin-1-yl]propanoic acid
CID 129497995
4-[2-(oxolan-2-yl)ethyl]morpholine
CID 130172160
N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]propan-1-amine
CID 65161038
(3R,4S)-1-[3-(oxolan-2-yl)propyl]pyrrolidine-3,4-diol
CID 79410973

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol?
The IUPAC name of 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol (CID 114510787) is 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol.
What is the SMILES notation for 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol?
The canonical SMILES for 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol is CCC1CN(CCC2CCCO2)CCC1O.
What is the InChIKey of 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol?
The InChIKey is XAACCSHLQFHIKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-2-11-10-14(8-6-13(11)15)7-5-12-4-3-9-16-12/h11-13,15H,2-10H2,1H3.
What are the key properties of 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol?
3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol has a molecular weight of 227.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol is sourced from PubChem (CID 114510787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).