4-ethyl-1,2,5-trimethylpiperidin-4-ol

C10H21NO — CID 2827413

IUPAC4-ethyl-1,2,5-trimethylpiperidin-4-ol
SMILESCCC1(O)CC(C)N(C)CC1C
InChIInChI=1S/C10H21NO/c1-5-10(12)6-9(3)11(4)7-8(10)2/h8-9,12H,5-7H2,1-4H3
InChIKeyXEOCATJPKSQIPI-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds1

About 4-ethyl-1,2,5-trimethylpiperidin-4-ol

4-ethyl-1,2,5-trimethylpiperidin-4-ol (PubChem CID 2827413) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-ethyl-1,2,5-trimethylpiperidin-4-ol.

Molecular Properties

Compound Name4-ethyl-1,2,5-trimethylpiperidin-4-ol
PubChem CID2827413
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-ethyl-1,2,5-trimethylpiperidin-4-ol
SMILESCCC1(O)CC(C)N(C)CC1C
InChIInChI=1S/C10H21NO/c1-5-10(12)6-9(3)11(4)7-8(10)2/h8-9,12H,5-7H2,1-4H3
InChIKeyXEOCATJPKSQIPI-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,2,5-trimethylpiperidin-4-ol?
The IUPAC name of 4-ethyl-1,2,5-trimethylpiperidin-4-ol (CID 2827413) is 4-ethyl-1,2,5-trimethylpiperidin-4-ol.
What is the SMILES notation for 4-ethyl-1,2,5-trimethylpiperidin-4-ol?
The canonical SMILES for 4-ethyl-1,2,5-trimethylpiperidin-4-ol is CCC1(O)CC(C)N(C)CC1C.
What is the InChIKey of 4-ethyl-1,2,5-trimethylpiperidin-4-ol?
The InChIKey is XEOCATJPKSQIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-10(12)6-9(3)11(4)7-8(10)2/h8-9,12H,5-7H2,1-4H3.
What are the key properties of 4-ethyl-1,2,5-trimethylpiperidin-4-ol?
4-ethyl-1,2,5-trimethylpiperidin-4-ol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,2,5-trimethylpiperidin-4-ol is sourced from PubChem (CID 2827413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).