2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate

C15H29NO3 — CID 129067600

IUPAC2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate
SMILESCCCC(=O)OCCN1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C15H29NO3/c1-6-7-13(18)19-9-8-16-14(2,3)10-12(17)11-15(16,4)5/h12,17H,6-11H2,1-5H3
InChIKeyBLCMVGIJASUMSX-UHFFFAOYSA-N
MW271.40 g/mol
LogP2.34
Rot. Bonds5

About 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate

2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate (PubChem CID 129067600) has the molecular formula C15H29NO3 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate.

Molecular Properties

Compound Name2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate
PubChem CID129067600
Molecular FormulaC15H29NO3
Molecular Weight271.40 g/mol
Exact Mass271.21
IUPAC Name2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate
SMILESCCCC(=O)OCCN1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C15H29NO3/c1-6-7-13(18)19-9-8-16-14(2,3)10-12(17)11-15(16,4)5/h12,17H,6-11H2,1-5H3
InChIKeyBLCMVGIJASUMSX-UHFFFAOYSA-N
XLogP2.34
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate?
The IUPAC name of 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate (CID 129067600) is 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate.
What is the SMILES notation for 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate?
The canonical SMILES for 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate is CCCC(=O)OCCN1C(C)(C)CC(O)CC1(C)C.
What is the InChIKey of 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate?
The InChIKey is BLCMVGIJASUMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO3/c1-6-7-13(18)19-9-8-16-14(2,3)10-12(17)11-15(16,4)5/h12,17H,6-11H2,1-5H3.
What are the key properties of 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate?
2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate has a molecular weight of 271.40 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl butanoate is sourced from PubChem (CID 129067600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).