5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid

C23H42N2O4 — CID 67842348

IUPAC5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid
SMILESCC1(C)CCCC(C)(C)N1OC(=O)C(CCC(=O)O)N1C(C)(C)CCCC1(C)C
InChIInChI=1S/C23H42N2O4/c1-20(2)13-9-14-21(3,4)24(20)17(11-12-18(26)27)19(28)29-25-22(5,6)15-10-16-23(25,7)8/h17H,9-16H2,1-8H3,(H,26,27)
InChIKeyPYYCUZLWGOJDGP-UHFFFAOYSA-N
MW410.60 g/mol
LogP4.76
Rot. Bonds6

About 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid

5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid (PubChem CID 67842348) has the molecular formula C23H42N2O4 and a molecular weight of 410.60 g/mol. Its IUPAC name is 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid.

Molecular Properties

Compound Name5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid
PubChem CID67842348
Molecular FormulaC23H42N2O4
Molecular Weight410.60 g/mol
Exact Mass410.31
IUPAC Name5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid
SMILESCC1(C)CCCC(C)(C)N1OC(=O)C(CCC(=O)O)N1C(C)(C)CCCC1(C)C
InChIInChI=1S/C23H42N2O4/c1-20(2)13-9-14-21(3,4)24(20)17(11-12-18(26)27)19(28)29-25-22(5,6)15-10-16-23(25,7)8/h17H,9-16H2,1-8H3,(H,26,27)
InChIKeyPYYCUZLWGOJDGP-UHFFFAOYSA-N
XLogP4.76
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.60
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,2,6,6-tetramethylpiperidin-1-yl) hydrogen carbonate
CID 22150807
4-(2,2,6,6-tetramethylpiperidin-1-yl)octadecanoic acid
CID 135235524
(2,2,6,6-tetramethylpiperidin-1-yl) N,N-dimethylcarbamate
CID 10242897
(2,2,6,6-tetramethylpiperidin-1-yl) N-methylcarbamate
CID 167207080
4-oxo-4-[[4-[(2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl]phenyl]methoxy]butanoic acid
CID 142744554
4-(1-methylcyclopropyl)oxybutanoic acid
CID 156904145
(2,2,6,6-tetramethylpiperidin-1-yl) 2-(furan-2-ylmethyl)-4-methyl-3-oxopentanoate
CID 11695973
(2,2,6,6-tetramethylpiperidin-1-yl) (E)-but-2-enoate
CID 66660803
CID 134893390
CID 134893390
2-[bis[carboxy-(2,2,6,6-tetramethylpiperidin-1-yl)methyl]amino]-2-(2,2,6,6-tetramethylpiperidin-1-yl)acetic acid
CID 141061575
4-[[2-[1-(aminomethyl)cyclohexyl]acetyl]amino]pentanoic acid
CID 112547674
(2,2,6,6-tetramethylpiperidin-1-yl) N-(2-ethylhexyl)carbamate
CID 166023714

Frequently Asked Questions

What is the IUPAC name of 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid?
The IUPAC name of 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid (CID 67842348) is 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid.
What is the SMILES notation for 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid?
The canonical SMILES for 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid is CC1(C)CCCC(C)(C)N1OC(=O)C(CCC(=O)O)N1C(C)(C)CCCC1(C)C.
What is the InChIKey of 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid?
The InChIKey is PYYCUZLWGOJDGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H42N2O4/c1-20(2)13-9-14-21(3,4)24(20)17(11-12-18(26)27)19(28)29-25-22(5,6)15-10-16-23(25,7)8/h17H,9-16H2,1-8H3,(H,26,27).
What are the key properties of 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid?
5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid has a molecular weight of 410.60 g/mol, XLogP of 4.76, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-4-(2,2,6,6-tetramethylpiperidin-1-yl)-5-(2,2,6,6-tetramethylpiperidin-1-yl)oxypentanoic acid is sourced from PubChem (CID 67842348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).