1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol

C9H21NO2 — CID 173152418

IUPAC1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol
SMILESCC1(C)CCC(C)(C)N1O.CO
InChIInChI=1S/C8H17NO.CH4O/c1-7(2)5-6-8(3,4)9(7)10;1-2/h10H,5-6H2,1-4H3;2H,1H3
InChIKeyOBUQZTHPCACOOR-UHFFFAOYSA-N
MW175.27 g/mol
LogP1.64
Rot. Bonds

About 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol

1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol (PubChem CID 173152418) has the molecular formula C9H21NO2 and a molecular weight of 175.27 g/mol. Its IUPAC name is 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol.

Molecular Properties

Compound Name1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol
PubChem CID173152418
Molecular FormulaC9H21NO2
Molecular Weight175.27 g/mol
Exact Mass175.16
IUPAC Name1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol
SMILESCC1(C)CCC(C)(C)N1O.CO
InChIInChI=1S/C8H17NO.CH4O/c1-7(2)5-6-8(3,4)9(7)10;1-2/h10H,5-6H2,1-4H3;2H,1H3
InChIKeyOBUQZTHPCACOOR-UHFFFAOYSA-N
XLogP1.64
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 549976
1-hydroxy-2,2,6,6-tetramethylpiperidine;methylimino(oxo)methane
CID 161040368
1-hydroxy-2,2,4,6,6-pentamethylpiperazine
CID 126542485
1-hydroxy-2,2,6,6-tetramethylpiperidine;2-methylprop-2-enoic acid
CID 132889909
1-hydroxypiperazine;1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 159092415
1-hydroxy-2,2,4,6,6-pentamethylpiperidine
CID 162143693
3-bromo-1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 141222515
4-amino-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol
CID 91600427
1-hydroxy-2,2,6,6-tetramethylpiperidin-4-imine
CID 57173064
1-hydroxy-2,2,7,7-tetramethylazepane-4-carboxylic acid
CID 18522538
1-hydroxy-N,2,2,6,6-pentamethylpiperidin-4-amine
CID 11853021
1-hydroxy-4-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-2,2,6,6-tetramethylpiperidin-4-ol
CID 173258983

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol?
The IUPAC name of 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol (CID 173152418) is 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol.
What is the SMILES notation for 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol?
The canonical SMILES for 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol is CC1(C)CCC(C)(C)N1O.CO.
What is the InChIKey of 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol?
The InChIKey is OBUQZTHPCACOOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.CH4O/c1-7(2)5-6-8(3,4)9(7)10;1-2/h10H,5-6H2,1-4H3;2H,1H3.
What are the key properties of 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol?
1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol has a molecular weight of 175.27 g/mol, XLogP of 1.64, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2,2,5,5-tetramethylpyrrolidine;methanol is sourced from PubChem (CID 173152418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).