2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol

C14H26N4O2 — CID 146036207

IUPAC2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol
SMILESCC(C)(O)c1cn(C2CC(C)(C)N(O)C(C)(C)C2)nn1
InChIInChI=1S/C14H26N4O2/c1-12(2)7-10(8-13(3,4)18(12)20)17-9-11(15-16-17)14(5,6)19/h9-10,19-20H,7-8H2,1-6H3
InChIKeyDKAFMDKXSXTGGA-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.09
Rot. Bonds2

About 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol

2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol (PubChem CID 146036207) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol.

Molecular Properties

Compound Name2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol
PubChem CID146036207
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol
SMILESCC(C)(O)c1cn(C2CC(C)(C)N(O)C(C)(C)C2)nn1
InChIInChI=1S/C14H26N4O2/c1-12(2)7-10(8-13(3,4)18(12)20)17-9-11(15-16-17)14(5,6)19/h9-10,19-20H,7-8H2,1-6H3
InChIKeyDKAFMDKXSXTGGA-UHFFFAOYSA-N
XLogP2.09
TPSA74.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol?
The IUPAC name of 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol (CID 146036207) is 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol.
What is the SMILES notation for 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol?
The canonical SMILES for 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol is CC(C)(O)c1cn(C2CC(C)(C)N(O)C(C)(C)C2)nn1.
What is the InChIKey of 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol?
The InChIKey is DKAFMDKXSXTGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-12(2)7-10(8-13(3,4)18(12)20)17-9-11(15-16-17)14(5,6)19/h9-10,19-20H,7-8H2,1-6H3.
What are the key properties of 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol?
2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol has a molecular weight of 282.39 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)triazol-4-yl]propan-2-ol is sourced from PubChem (CID 146036207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).