4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one

C14H24N6O — CID 81007063

IUPAC4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one
SMILESCCc1nc(NN)c(C)c(N2CCN(C)C(=O)C2(C)C)n1
InChIInChI=1S/C14H24N6O/c1-6-10-16-11(18-15)9(2)12(17-10)20-8-7-19(5)13(21)14(20,3)4/h6-8,15H2,1-5H3,(H,16,17,18)
InChIKeyTZFGBKBHEFDGFB-UHFFFAOYSA-N
MW292.39 g/mol
LogP0.69
Rot. Bonds3

About 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one

4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one (PubChem CID 81007063) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one.

Molecular Properties

Compound Name4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one
PubChem CID81007063
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one
SMILESCCc1nc(NN)c(C)c(N2CCN(C)C(=O)C2(C)C)n1
InChIInChI=1S/C14H24N6O/c1-6-10-16-11(18-15)9(2)12(17-10)20-8-7-19(5)13(21)14(20,3)4/h6-8,15H2,1-5H3,(H,16,17,18)
InChIKeyTZFGBKBHEFDGFB-UHFFFAOYSA-N
XLogP0.69
TPSA87.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one
CID 81006102
N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 107165595
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidin-3-ol
CID 81006896
7-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 81006622
[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 113336423
[6-(2,6-dimethylthiomorpholin-4-yl)-2-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 81007728
[6-(azetidin-1-yl)-2-ethyl-5-fluoropyrimidin-4-yl]hydrazine
CID 66936000
2-ethyl-6-hydrazinyl-5-methyl-N-(1-methylcyclopentyl)pyrimidin-4-amine
CID 81006586
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-3-amine
CID 81006239
1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-4-methylazepan-4-ol
CID 107409163
2-ethyl-6-hydrazinyl-5-methyl-N-(1-methylcyclohexyl)pyrimidin-4-amine
CID 81006055
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103198717

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one?
The IUPAC name of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one (CID 81007063) is 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one.
What is the SMILES notation for 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one?
The canonical SMILES for 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one is CCc1nc(NN)c(C)c(N2CCN(C)C(=O)C2(C)C)n1.
What is the InChIKey of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one?
The InChIKey is TZFGBKBHEFDGFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-6-10-16-11(18-15)9(2)12(17-10)20-8-7-19(5)13(21)14(20,3)4/h6-8,15H2,1-5H3,(H,16,17,18).
What are the key properties of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one?
4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one has a molecular weight of 292.39 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,3,3-trimethylpiperazin-2-one is sourced from PubChem (CID 81007063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).