N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide

C16H20N4O3S — CID 8933526

IUPACN-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cnc(C)cn2)c1
InChIInChI=1S/C16H20N4O3S/c1-4-20(5-2)24(22,23)14-8-6-7-13(9-14)19-16(21)15-11-17-12(3)10-18-15/h6-11H,4-5H2,1-3H3,(H,19,21)
InChIKeyJKQOCQBVJVAKMA-UHFFFAOYSA-N
MW348.43 g/mol
LogP2.07
Rot. Bonds6

About N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide

N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide (PubChem CID 8933526) has the molecular formula C16H20N4O3S and a molecular weight of 348.43 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide
PubChem CID8933526
Molecular FormulaC16H20N4O3S
Molecular Weight348.43 g/mol
Exact Mass348.13
IUPAC NameN-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cnc(C)cn2)c1
InChIInChI=1S/C16H20N4O3S/c1-4-20(5-2)24(22,23)14-8-6-7-13(9-14)19-16(21)15-11-17-12(3)10-18-15/h6-11H,4-5H2,1-3H3,(H,19,21)
InChIKeyJKQOCQBVJVAKMA-UHFFFAOYSA-N
XLogP2.07
TPSA92.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[3-(diethylsulfamoyl)anilino]-2-oxoethyl] 5-methylpyrazine-2-carboxylate
CID 7950215
N-[3-(diethylsulfamoyl)phenyl]naphthalene-2-carboxamide
CID 7760022
N-[3-(diethylsulfamoyl)phenyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 4851816
5-methyl-N-[3-(methylaminomethyl)phenyl]pyrazine-2-carboxamide
CID 43601855
4-acetamido-N-[3-(diethylsulfamoyl)phenyl]benzamide
CID 7760016
N-[3-(diethylsulfamoyl)phenyl]-3-fluorobenzamide
CID 4800184
N-[3-(diethylsulfamoyl)phenyl]naphthalene-1-carboxamide
CID 26252213
N-[3-(diethylsulfamoyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 4043210
5-chloro-N-(3-methylsulfonylphenyl)pyrazine-2-carboxamide
CID 103803477
3-chloro-N-[3-(diethylsulfamoyl)phenyl]-4,5-dimethoxybenzamide
CID 26252009
[(2R)-1-[3-(dimethylsulfamoyl)anilino]-1-oxopropan-2-yl] 5-methylpyrazine-2-carboxylate
CID 7950162
N-[3-(diethylsulfamoyl)phenyl]-2,4-difluorobenzamide
CID 7760043

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide?
The IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide (CID 8933526) is N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cnc(C)cn2)c1.
What is the InChIKey of N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide?
The InChIKey is JKQOCQBVJVAKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3S/c1-4-20(5-2)24(22,23)14-8-6-7-13(9-14)19-16(21)15-11-17-12(3)10-18-15/h6-11H,4-5H2,1-3H3,(H,19,21).
What are the key properties of N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide?
N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide has a molecular weight of 348.43 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylsulfamoyl)phenyl]-5-methylpyrazine-2-carboxamide is sourced from PubChem (CID 8933526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).