4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide

C11H19N5O3S — CID 154736074

IUPAC4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide
SMILESCCn1ccnc(N2CCN(S(=O)(=O)NC)CC2)c1=O
InChIInChI=1S/C11H19N5O3S/c1-3-14-5-4-13-10(11(14)17)15-6-8-16(9-7-15)20(18,19)12-2/h4-5,12H,3,6-9H2,1-2H3
InChIKeyZKFKTZHFDUIMTL-UHFFFAOYSA-N
MW301.37 g/mol
LogP-1.15
Rot. Bonds4

About 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide

4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide (PubChem CID 154736074) has the molecular formula C11H19N5O3S and a molecular weight of 301.37 g/mol. Its IUPAC name is 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide.

Molecular Properties

Compound Name4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide
PubChem CID154736074
Molecular FormulaC11H19N5O3S
Molecular Weight301.37 g/mol
Exact Mass301.12
IUPAC Name4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide
SMILESCCn1ccnc(N2CCN(S(=O)(=O)NC)CC2)c1=O
InChIInChI=1S/C11H19N5O3S/c1-3-14-5-4-13-10(11(14)17)15-6-8-16(9-7-15)20(18,19)12-2/h4-5,12H,3,6-9H2,1-2H3
InChIKeyZKFKTZHFDUIMTL-UHFFFAOYSA-N
XLogP-1.15
TPSA87.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 5-1.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-ethyl-3-[4-(methylamino)piperidin-1-yl]pyrazin-2-one
CID 62939421
1-ethyl-3-[4-(2-hydroxyphenyl)piperazin-1-yl]pyrazin-2-one
CID 133447156
3-(2,6-dimethylmorpholin-4-yl)-1-ethylpyrazin-2-one
CID 133446960
3-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-1-ethylpyrazin-2-one
CID 55219868
3-(3-aminopyrrolidin-1-yl)-1-ethylpyrazin-2-one
CID 62928142
1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one
CID 146125355
1-ethyl-3-[4-[(6-ethyl-5-fluoropyrimidin-4-yl)amino]piperidin-1-yl]pyrazin-2-one
CID 129007467
3-[4-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]ethyl]piperidin-1-yl]-1-ethylpyrazin-2-one
CID 124515157
1-ethyl-3-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]pyrazin-2-one
CID 62929242
3-(3-chloropiperidin-1-yl)-1-ethylpyrazin-2-one
CID 63392087
3-[4-[(6-ethoxypyrimidin-4-yl)amino]piperidin-1-yl]-1-ethylpyrazin-2-one
CID 75509073
1-ethyl-3-[3-hydroxy-3-(trifluoromethyl)pyrrolidin-1-yl]pyrazin-2-one
CID 136520233

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide?
The IUPAC name of 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide (CID 154736074) is 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide.
What is the SMILES notation for 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide?
The canonical SMILES for 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide is CCn1ccnc(N2CCN(S(=O)(=O)NC)CC2)c1=O.
What is the InChIKey of 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide?
The InChIKey is ZKFKTZHFDUIMTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O3S/c1-3-14-5-4-13-10(11(14)17)15-6-8-16(9-7-15)20(18,19)12-2/h4-5,12H,3,6-9H2,1-2H3.
What are the key properties of 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide?
4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide has a molecular weight of 301.37 g/mol, XLogP of -1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide is sourced from PubChem (CID 154736074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).