4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one

C12H20N6O — CID 81006102

IUPAC4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one
SMILESCCc1nc(NN)c(C)c(N2CCN(C)C(=O)C2)n1
InChIInChI=1S/C12H20N6O/c1-4-9-14-11(16-13)8(2)12(15-9)18-6-5-17(3)10(19)7-18/h4-7,13H2,1-3H3,(H,14,15,16)
InChIKeyBUDAXXKYCNKULN-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.09
Rot. Bonds3

About 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one

4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one (PubChem CID 81006102) has the molecular formula C12H20N6O and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one.

Molecular Properties

Compound Name4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one
PubChem CID81006102
Molecular FormulaC12H20N6O
Molecular Weight264.33 g/mol
Exact Mass264.17
IUPAC Name4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one
SMILESCCc1nc(NN)c(C)c(N2CCN(C)C(=O)C2)n1
InChIInChI=1S/C12H20N6O/c1-4-9-14-11(16-13)8(2)12(15-9)18-6-5-17(3)10(19)7-18/h4-7,13H2,1-3H3,(H,14,15,16)
InChIKeyBUDAXXKYCNKULN-UHFFFAOYSA-N
XLogP-0.09
TPSA87.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.09
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)-1,3,3-trimethylpiperazin-2-one
CID 81007063
[6-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 81006440
4-[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-1-methylpiperazin-2-one
CID 80844651
7-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 81006622
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidin-3-ol
CID 81006896
[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
4-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]-1-methyl-1,4-diazepan-2-one
CID 102887894
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-N,N-dimethylpiperidin-3-amine
CID 81006239
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103198717
[6-(azetidin-1-yl)-2-ethyl-5-fluoropyrimidin-4-yl]hydrazine
CID 66936000
2-ethyl-N,5-dimethyl-6-piperazin-1-ylpyrimidin-4-amine
CID 80983428

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one?
The IUPAC name of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one (CID 81006102) is 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one.
What is the SMILES notation for 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one?
The canonical SMILES for 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one is CCc1nc(NN)c(C)c(N2CCN(C)C(=O)C2)n1.
What is the InChIKey of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one?
The InChIKey is BUDAXXKYCNKULN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6O/c1-4-9-14-11(16-13)8(2)12(15-9)18-6-5-17(3)10(19)7-18/h4-7,13H2,1-3H3,(H,14,15,16).
What are the key properties of 4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one?
4-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one has a molecular weight of 264.33 g/mol, XLogP of -0.09, 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-methylpiperazin-2-one is sourced from PubChem (CID 81006102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).