1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine

C9H18N2O — CID 143150178

IUPAC1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine
SMILES[H]/N=C1\N(O)CC(C)C(C)C1(C)C
InChIInChI=1S/C9H18N2O/c1-6-5-11(12)8(10)9(3,4)7(6)2/h6-7,10,12H,5H2,1-4H3/b10-8-
InChIKeyJLSWXQIYBQRVKQ-NTMALXAHSA-N
MW170.26 g/mol
LogP1.97
Rot. Bonds

About 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine

1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine (PubChem CID 143150178) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine.

Molecular Properties

Compound Name1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine
PubChem CID143150178
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine
SMILES[H]/N=C1\N(O)CC(C)C(C)C1(C)C
InChIInChI=1S/C9H18N2O/c1-6-5-11(12)8(10)9(3,4)7(6)2/h6-7,10,12H,5H2,1-4H3/b10-8-
InChIKeyJLSWXQIYBQRVKQ-NTMALXAHSA-N
XLogP1.97
TPSA47.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine?
The IUPAC name of 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine (CID 143150178) is 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine.
What is the SMILES notation for 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine?
The canonical SMILES for 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine is [H]/N=C1\N(O)CC(C)C(C)C1(C)C.
What is the InChIKey of 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine?
The InChIKey is JLSWXQIYBQRVKQ-NTMALXAHSA-N. The full InChI is InChI=1S/C9H18N2O/c1-6-5-11(12)8(10)9(3,4)7(6)2/h6-7,10,12H,5H2,1-4H3/b10-8-.
What are the key properties of 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine?
1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine has a molecular weight of 170.26 g/mol, XLogP of 1.97, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3,3,4,5-tetramethylpiperidin-2-imine is sourced from PubChem (CID 143150178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).