(5-ethoxy-5-ethylpiperidin-2-yl)methanol

C10H21NO2 — CID 134408412

IUPAC(5-ethoxy-5-ethylpiperidin-2-yl)methanol
SMILESCCOC1(CC)CCC(CO)NC1
InChIInChI=1S/C10H21NO2/c1-3-10(13-4-2)6-5-9(7-12)11-8-10/h9,11-12H,3-8H2,1-2H3
InChIKeyXGNRRGGYVZERIK-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.92
Rot. Bonds4

About (5-ethoxy-5-ethylpiperidin-2-yl)methanol

(5-ethoxy-5-ethylpiperidin-2-yl)methanol (PubChem CID 134408412) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is (5-ethoxy-5-ethylpiperidin-2-yl)methanol.

Molecular Properties

Compound Name(5-ethoxy-5-ethylpiperidin-2-yl)methanol
PubChem CID134408412
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name(5-ethoxy-5-ethylpiperidin-2-yl)methanol
SMILESCCOC1(CC)CCC(CO)NC1
InChIInChI=1S/C10H21NO2/c1-3-10(13-4-2)6-5-9(7-12)11-8-10/h9,11-12H,3-8H2,1-2H3
InChIKeyXGNRRGGYVZERIK-UHFFFAOYSA-N
XLogP0.92
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-ethoxy-5-ethylpiperidin-2-yl)methanol?
The IUPAC name of (5-ethoxy-5-ethylpiperidin-2-yl)methanol (CID 134408412) is (5-ethoxy-5-ethylpiperidin-2-yl)methanol.
What is the SMILES notation for (5-ethoxy-5-ethylpiperidin-2-yl)methanol?
The canonical SMILES for (5-ethoxy-5-ethylpiperidin-2-yl)methanol is CCOC1(CC)CCC(CO)NC1.
What is the InChIKey of (5-ethoxy-5-ethylpiperidin-2-yl)methanol?
The InChIKey is XGNRRGGYVZERIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-10(13-4-2)6-5-9(7-12)11-8-10/h9,11-12H,3-8H2,1-2H3.
What are the key properties of (5-ethoxy-5-ethylpiperidin-2-yl)methanol?
(5-ethoxy-5-ethylpiperidin-2-yl)methanol has a molecular weight of 187.28 g/mol, XLogP of 0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethoxy-5-ethylpiperidin-2-yl)methanol is sourced from PubChem (CID 134408412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).