1,3,5,6-tetramethylpiperazin-2-one

C8H16N2O — CID 122163249

IUPAC1,3,5,6-tetramethylpiperazin-2-one
SMILESCC1NC(C)C(C)N(C)C1=O
InChIInChI=1S/C8H16N2O/c1-5-7(3)10(4)8(11)6(2)9-5/h5-7,9H,1-4H3
InChIKeyOHBCFTSUBNDCJA-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.21
Rot. Bonds

About 1,3,5,6-tetramethylpiperazin-2-one

1,3,5,6-tetramethylpiperazin-2-one (PubChem CID 122163249) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1,3,5,6-tetramethylpiperazin-2-one.

Molecular Properties

Compound Name1,3,5,6-tetramethylpiperazin-2-one
PubChem CID122163249
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1,3,5,6-tetramethylpiperazin-2-one
SMILESCC1NC(C)C(C)N(C)C1=O
InChIInChI=1S/C8H16N2O/c1-5-7(3)10(4)8(11)6(2)9-5/h5-7,9H,1-4H3
InChIKeyOHBCFTSUBNDCJA-UHFFFAOYSA-N
XLogP0.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3,5,6-tetramethylpiperazin-2-one?
The IUPAC name of 1,3,5,6-tetramethylpiperazin-2-one (CID 122163249) is 1,3,5,6-tetramethylpiperazin-2-one.
What is the SMILES notation for 1,3,5,6-tetramethylpiperazin-2-one?
The canonical SMILES for 1,3,5,6-tetramethylpiperazin-2-one is CC1NC(C)C(C)N(C)C1=O.
What is the InChIKey of 1,3,5,6-tetramethylpiperazin-2-one?
The InChIKey is OHBCFTSUBNDCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-5-7(3)10(4)8(11)6(2)9-5/h5-7,9H,1-4H3.
What are the key properties of 1,3,5,6-tetramethylpiperazin-2-one?
1,3,5,6-tetramethylpiperazin-2-one has a molecular weight of 156.23 g/mol, XLogP of 0.21, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5,6-tetramethylpiperazin-2-one is sourced from PubChem (CID 122163249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).