butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol

C17H33NO6 — CID 126506371

IUPACbutanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC(C)(O)CN1C(C)(C)CC(O)CC1(C)C.O=C(O)CCC(=O)O
InChIInChI=1S/C13H27NO2.C4H6O4/c1-11(2)7-10(15)8-12(3,4)14(11)9-13(5,6)16;5-3(6)1-2-4(7)8/h10,15-16H,7-9H2,1-6H3;1-2H2,(H,5,6)(H,7,8)
InChIKeyHVMBTXJTJYXGBG-UHFFFAOYSA-N
MW347.45 g/mol
LogP1.71
Rot. Bonds5

About butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol

butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol (PubChem CID 126506371) has the molecular formula C17H33NO6 and a molecular weight of 347.45 g/mol. Its IUPAC name is butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol.

Molecular Properties

Compound Namebutanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol
PubChem CID126506371
Molecular FormulaC17H33NO6
Molecular Weight347.45 g/mol
Exact Mass347.23
IUPAC Namebutanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC(C)(O)CN1C(C)(C)CC(O)CC1(C)C.O=C(O)CCC(=O)O
InChIInChI=1S/C13H27NO2.C4H6O4/c1-11(2)7-10(15)8-12(3,4)14(11)9-13(5,6)16;5-3(6)1-2-4(7)8/h10,15-16H,7-9H2,1-6H3;1-2H2,(H,5,6)(H,7,8)
InChIKeyHVMBTXJTJYXGBG-UHFFFAOYSA-N
XLogP1.71
TPSA118.30 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.45
LogP ≤ 51.71
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol with MolForge

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Related Compounds

butane-1,2,3,4-tetracarboxylic acid;1,2,2,6,6-pentamethylpiperidin-4-ol
CID 67948772
1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-ol
CID 6850828
2,3-dimethylbutanedioic acid;1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-ol
CID 158949266
4-(1-ethyl-2,2,6,6-tetramethylpiperidin-4-yl)oxy-4-oxobutanoic acid
CID 67533775
10-[4-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxy-2,2,6,6-tetramethylpiperidin-1-yl]oxy-10-oxodecanoic acid
CID 70489036
2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid;pentakis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol)
CID 173025963
1-(2-hydroxy-2-methylpropyl)-4,4-dimethylpyrrolidin-3-ol
CID 126992519
1-(2-hydroxy-2-methylpropyl)piperidin-4-ol
CID 60886320
3-(6-hydroxy-2-methyl-5,7-dipropyl-1,3-diazatricyclo[3.3.1.13,7]decan-2-yl)propanoic acid
CID 50998293
cyclohex-4-ene-1,2-dicarboxylic acid;1-dodecyl-2,2,6,6-tetramethylpiperidin-4-ol
CID 70599265
ethanol;hexanedioic acid;2,2,6,6-tetramethylpiperidin-4-ol
CID 174733730
1-(5,5-dimethylhex-1-enyl)-2,2,6,6-tetramethylpiperidin-4-ol
CID 139667999

Frequently Asked Questions

What is the IUPAC name of butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol?
The IUPAC name of butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol (CID 126506371) is butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol.
What is the SMILES notation for butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol?
The canonical SMILES for butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol is CC(C)(O)CN1C(C)(C)CC(O)CC1(C)C.O=C(O)CCC(=O)O.
What is the InChIKey of butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol?
The InChIKey is HVMBTXJTJYXGBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2.C4H6O4/c1-11(2)7-10(15)8-12(3,4)14(11)9-13(5,6)16;5-3(6)1-2-4(7)8/h10,15-16H,7-9H2,1-6H3;1-2H2,(H,5,6)(H,7,8).
What are the key properties of butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol?
butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol has a molecular weight of 347.45 g/mol, XLogP of 1.71, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for butanedioic acid;1-(2-hydroxy-2-methylpropyl)-2,2,6,6-tetramethylpiperidin-4-ol is sourced from PubChem (CID 126506371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).