1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate

C15H27NO5 — CID 70364233

IUPAC1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate
SMILESCC1(C)CC(OC(=O)CCC(=O)OCCO)CC(C)(C)N1
InChIInChI=1S/C15H27NO5/c1-14(2)9-11(10-15(3,4)16-14)21-13(19)6-5-12(18)20-8-7-17/h11,16-17H,5-10H2,1-4H3
InChIKeyQFMRXTTWEQRZAV-UHFFFAOYSA-N
MW301.38 g/mol
LogP1.15
Rot. Bonds6

About 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate

1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate (PubChem CID 70364233) has the molecular formula C15H27NO5 and a molecular weight of 301.38 g/mol. Its IUPAC name is 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate.

Molecular Properties

Compound Name1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate
PubChem CID70364233
Molecular FormulaC15H27NO5
Molecular Weight301.38 g/mol
Exact Mass301.19
IUPAC Name1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate
SMILESCC1(C)CC(OC(=O)CCC(=O)OCCO)CC(C)(C)N1
InChIInChI=1S/C15H27NO5/c1-14(2)9-11(10-15(3,4)16-14)21-13(19)6-5-12(18)20-8-7-17/h11,16-17H,5-10H2,1-4H3
InChIKeyQFMRXTTWEQRZAV-UHFFFAOYSA-N
XLogP1.15
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.38
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;decanedioic acid
CID 159079251
bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;(2,2,6,6-tetramethylpiperidin-4-yl) butanoate
CID 161160145
1-O-[3-methyl-3-(2-methylbutan-2-ylamino)butyl] 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate
CID 123374150
(2,2,6,6-tetramethylpiperidin-4-yl) 6-prop-2-enoyloxyhexanoate
CID 90295268
(2,2,6,6-tetramethylpiperidin-4-yl) 10-oxodecanoate
CID 126551822
bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;2,2,6,6-tetramethylpiperidin-4-one
CID 137378199
4-oxo-4-piperidin-1-yloxybutanoic acid;4-oxo-4-(2,2,6,6-tetramethylpiperidin-4-yl)oxybutanoic acid
CID 159996493
2-O,3-O,4-O-tris(2,2,6,6-tetramethylpiperidin-4-yl) 1-O-tridecyl butane-1,2,3,4-tetracarboxylate
CID 6365990
bis(2,2,6-trimethyl-6-propan-2-ylpiperidin-4-yl) heptanedioate
CID 121244522
iodo (2,2,6,6-tetramethylpiperidin-4-yl) carbonate
CID 163508092
bis(2,2,6,6-tetramethylpiperidin-4-yl) 2-methylidenebutanedioate
CID 21134251
tetrakis(2,2,6,6-tetramethylpiperidin-4-yl) ethene-1,1,2,2-tetracarboxylate
CID 22761497

Frequently Asked Questions

What is the IUPAC name of 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate?
The IUPAC name of 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate (CID 70364233) is 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate.
What is the SMILES notation for 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate?
The canonical SMILES for 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate is CC1(C)CC(OC(=O)CCC(=O)OCCO)CC(C)(C)N1.
What is the InChIKey of 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate?
The InChIKey is QFMRXTTWEQRZAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO5/c1-14(2)9-11(10-15(3,4)16-14)21-13(19)6-5-12(18)20-8-7-17/h11,16-17H,5-10H2,1-4H3.
What are the key properties of 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate?
1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate has a molecular weight of 301.38 g/mol, XLogP of 1.15, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-O-(2-hydroxyethyl) 4-O-(2,2,6,6-tetramethylpiperidin-4-yl) butanedioate is sourced from PubChem (CID 70364233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).