1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine

C9H17NO — CID 15625955

IUPAC1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine
SMILESCC1(C)C=CC(C)(C)N(O)C1
InChIInChI=1S/C9H17NO/c1-8(2)5-6-9(3,4)10(11)7-8/h5-6,11H,7H2,1-4H3
InChIKeyHRGUPMDXHDDGOH-UHFFFAOYSA-N
MW155.24 g/mol
LogP2.05
Rot. Bonds

About 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine

1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine (PubChem CID 15625955) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine.

Molecular Properties

Compound Name1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine
PubChem CID15625955
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine
SMILESCC1(C)C=CC(C)(C)N(O)C1
InChIInChI=1S/C9H17NO/c1-8(2)5-6-9(3,4)10(11)7-8/h5-6,11H,7H2,1-4H3
InChIKeyHRGUPMDXHDDGOH-UHFFFAOYSA-N
XLogP2.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-hydroxy-5,5,6,6-tetramethyl-2H-pyridine
CID 91106388
1-ethyl-3,3,6,6-tetramethyl-2H-pyridine
CID 139630080
ethane;1-hydroxy-5-methyl-3,6-dihydro-2H-pyridine
CID 142290952
ethane;1-hydroxy-2,5,5-trimethyl-2H-pyrrole
CID 142903338

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine?
The IUPAC name of 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine (CID 15625955) is 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine.
What is the SMILES notation for 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine?
The canonical SMILES for 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine is CC1(C)C=CC(C)(C)N(O)C1.
What is the InChIKey of 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine?
The InChIKey is HRGUPMDXHDDGOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(2)5-6-9(3,4)10(11)7-8/h5-6,11H,7H2,1-4H3.
What are the key properties of 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine?
1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine has a molecular weight of 155.24 g/mol, XLogP of 2.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3,3,6,6-tetramethyl-2H-pyridine is sourced from PubChem (CID 15625955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).