4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol

C9H20N2O2 — CID 91600427

IUPAC4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CC(N)(O)CC(C)(C)N1O
InChIInChI=1S/C9H20N2O2/c1-7(2)5-9(10,12)6-8(3,4)11(7)13/h12-13H,5-6,10H2,1-4H3
InChIKeyHXTMTRMZPRCOKU-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.68
Rot. Bonds

About 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol

4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol (PubChem CID 91600427) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol.

Molecular Properties

Compound Name4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol
PubChem CID91600427
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CC(N)(O)CC(C)(C)N1O
InChIInChI=1S/C9H20N2O2/c1-7(2)5-9(10,12)6-8(3,4)11(7)13/h12-13H,5-6,10H2,1-4H3
InChIKeyHXTMTRMZPRCOKU-UHFFFAOYSA-N
XLogP0.68
TPSA69.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol?
The IUPAC name of 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol (CID 91600427) is 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol.
What is the SMILES notation for 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol?
The canonical SMILES for 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol is CC1(C)CC(N)(O)CC(C)(C)N1O.
What is the InChIKey of 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol?
The InChIKey is HXTMTRMZPRCOKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-7(2)5-9(10,12)6-8(3,4)11(7)13/h12-13H,5-6,10H2,1-4H3.
What are the key properties of 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol?
4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol has a molecular weight of 188.27 g/mol, XLogP of 0.68, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol is sourced from PubChem (CID 91600427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).