1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one

C12H24N2O2 — CID 12580998

IUPAC1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one
SMILESCC1(C)CN(C(C)(C)CO)C(=O)C(C)(C)N1
InChIInChI=1S/C12H24N2O2/c1-10(2)7-14(11(3,4)8-15)9(16)12(5,6)13-10/h13,15H,7-8H2,1-6H3
InChIKeyHBGOTNTZEOHFNM-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.75
Rot. Bonds2

About 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one

1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one (PubChem CID 12580998) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one.

Molecular Properties

Compound Name1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one
PubChem CID12580998
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one
SMILESCC1(C)CN(C(C)(C)CO)C(=O)C(C)(C)N1
InChIInChI=1S/C12H24N2O2/c1-10(2)7-14(11(3,4)8-15)9(16)12(5,6)13-10/h13,15H,7-8H2,1-6H3
InChIKeyHBGOTNTZEOHFNM-UHFFFAOYSA-N
XLogP0.75
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one?
The IUPAC name of 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one (CID 12580998) is 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one.
What is the SMILES notation for 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one?
The canonical SMILES for 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one is CC1(C)CN(C(C)(C)CO)C(=O)C(C)(C)N1.
What is the InChIKey of 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one?
The InChIKey is HBGOTNTZEOHFNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-10(2)7-14(11(3,4)8-15)9(16)12(5,6)13-10/h13,15H,7-8H2,1-6H3.
What are the key properties of 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one?
1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one has a molecular weight of 228.34 g/mol, XLogP of 0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydroxy-2-methylpropan-2-yl)-3,3,5,5-tetramethylpiperazin-2-one is sourced from PubChem (CID 12580998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).