1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol

C11H23NO3 — CID 106939406

IUPAC1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol
SMILESCCOCC(O)COCC1CCCCN1
InChIInChI=1S/C11H23NO3/c1-2-14-8-11(13)9-15-7-10-5-3-4-6-12-10/h10-13H,2-9H2,1H3
InChIKeyMCOKZQZGTVHRCU-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.54
Rot. Bonds7

About 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol

1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol (PubChem CID 106939406) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol.

Molecular Properties

Compound Name1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol
PubChem CID106939406
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol
SMILESCCOCC(O)COCC1CCCCN1
InChIInChI=1S/C11H23NO3/c1-2-14-8-11(13)9-15-7-10-5-3-4-6-12-10/h10-13H,2-9H2,1H3
InChIKeyMCOKZQZGTVHRCU-UHFFFAOYSA-N
XLogP0.54
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethoxymethyl)azepane
CID 79569846
(2S)-2-(1-ethoxypropan-2-yloxymethyl)pyrrolidine
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2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine
CID 145216939
2-(2-propoxyethoxymethyl)piperidine
CID 63684377
2-(2-methylprop-2-enoxymethyl)piperidine
CID 62339397
1-ethoxy-3-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]propan-2-ol
CID 106617981
1,3-diethoxypropan-2-yl (2S)-piperidine-2-carboxylate
CID 59049625
1-phenyl-2-(pyrrolidin-2-ylmethoxy)ethanol
CID 106939448
(2R)-2-[2-(2-methylpropoxy)ethoxymethyl]pyrrolidine
CID 106447713
ethyl 2-(pyrrolidin-2-ylmethoxy)acetate
CID 106939447
2-(2,2,2-trifluoroethoxymethyl)piperidine
CID 24702991
2-(pentan-2-yloxymethyl)piperidine
CID 102981941

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol?
The IUPAC name of 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol (CID 106939406) is 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol.
What is the SMILES notation for 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol?
The canonical SMILES for 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol is CCOCC(O)COCC1CCCCN1.
What is the InChIKey of 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol?
The InChIKey is MCOKZQZGTVHRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-2-14-8-11(13)9-15-7-10-5-3-4-6-12-10/h10-13H,2-9H2,1H3.
What are the key properties of 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol?
1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol has a molecular weight of 217.31 g/mol, XLogP of 0.54, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-3-(piperidin-2-ylmethoxy)propan-2-ol is sourced from PubChem (CID 106939406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).