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

C11H23NO2 — CID 47811095

IUPAC1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol
SMILESCC(C)(C)OCCN1CCCC(O)C1
InChIInChI=1S/C11H23NO2/c1-11(2,3)14-8-7-12-6-4-5-10(13)9-12/h10,13H,4-9H2,1-3H3
InChIKeyIWZFBJWEFAWJJS-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.26
Rot. Bonds3

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

1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol (PubChem CID 47811095) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol
PubChem CID47811095
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol
SMILESCC(C)(C)OCCN1CCCC(O)C1
InChIInChI=1S/C11H23NO2/c1-11(2,3)14-8-7-12-6-4-5-10(13)9-12/h10,13H,4-9H2,1-3H3
InChIKeyIWZFBJWEFAWJJS-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol?
The IUPAC name of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol (CID 47811095) is 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol.
What is the SMILES notation for 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol?
The canonical SMILES for 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol is CC(C)(C)OCCN1CCCC(O)C1.
What is the InChIKey of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol?
The InChIKey is IWZFBJWEFAWJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-11(2,3)14-8-7-12-6-4-5-10(13)9-12/h10,13H,4-9H2,1-3H3.
What are the key properties of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol?
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol has a molecular weight of 201.31 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-ol is sourced from PubChem (CID 47811095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).