1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one

C9H16N2O — CID 89057683

IUPAC1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one
SMILESC=C1N(C)CC(=O)N(C)C1(C)C
InChIInChI=1S/C9H16N2O/c1-7-9(2,3)11(5)8(12)6-10(7)4/h1,6H2,2-5H3
InChIKeyACVHGBNPNHZIGJ-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.68
Rot. Bonds

About 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one

1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one (PubChem CID 89057683) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one.

Molecular Properties

Compound Name1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one
PubChem CID89057683
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one
SMILESC=C1N(C)CC(=O)N(C)C1(C)C
InChIInChI=1S/C9H16N2O/c1-7-9(2,3)11(5)8(12)6-10(7)4/h1,6H2,2-5H3
InChIKeyACVHGBNPNHZIGJ-UHFFFAOYSA-N
XLogP0.68
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,6,6-Trimethyl-4-propan-2-yl-5-propan-2-ylidenepiperazin-2-one
CID 59346692
1-But-3-enyl-4-tert-butylpiperazin-2-one
CID 69155456
1,4,6,6-Tetramethyl-5-propan-2-ylidenepiperazin-2-one
CID 89042011
1,4-Ditert-butyl-5-methylidenepiperazin-2-one
CID 90134196
1,4-Ditert-butyl-3-methylidenepiperazin-2-one
CID 90134200
1-[4-(3-Methylbut-1-en-2-yl)piperazin-1-yl]ethanone
CID 131971579
4-Ethyl-1-methyl-6-methylidenepiperazin-2-one
CID 141954425
N-but-1-en-2-yl-N-methyl-2-piperidin-1-ylacetamide
CID 142849198
Butane;ethane;1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one
CID 143067244
1,4-Dimethyl-6-methylidenepiperazin-2-one;ethane
CID 144002408
1-Methyl-4-(2-methylbut-3-en-2-yl)piperazine-2,6-dione
CID 146221321
1-Ethyl-4-prop-1-en-2-ylpiperazin-2-one
CID 153368023

Frequently Asked Questions

What is the IUPAC name of 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one?
The IUPAC name of 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one (CID 89057683) is 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one.
What is the SMILES notation for 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one?
The canonical SMILES for 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one is C=C1N(C)CC(=O)N(C)C1(C)C.
What is the InChIKey of 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one?
The InChIKey is ACVHGBNPNHZIGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-7-9(2,3)11(5)8(12)6-10(7)4/h1,6H2,2-5H3.
What are the key properties of 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one?
1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one has a molecular weight of 168.24 g/mol, XLogP of 0.68, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,6,6-tetramethyl-5-methylidenepiperazin-2-one is sourced from PubChem (CID 89057683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).