2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide

C12H15N5O2S — CID 62840002

IUPAC2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)NCc2cnc(C)cn2)ccn1
InChIInChI=1S/C12H15N5O2S/c1-9-6-16-10(7-15-9)8-17-20(18,19)11-3-4-14-12(5-11)13-2/h3-7,17H,8H2,1-2H3,(H,13,14)
InChIKeyOHMURGPVYBXDKY-UHFFFAOYSA-N
MW293.35 g/mol
LogP0.70
Rot. Bonds5

About 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide

2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide (PubChem CID 62840002) has the molecular formula C12H15N5O2S and a molecular weight of 293.35 g/mol. Its IUPAC name is 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide
PubChem CID62840002
Molecular FormulaC12H15N5O2S
Molecular Weight293.35 g/mol
Exact Mass293.09
IUPAC Name2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)NCc2cnc(C)cn2)ccn1
InChIInChI=1S/C12H15N5O2S/c1-9-6-16-10(7-15-9)8-17-20(18,19)11-3-4-14-12(5-11)13-2/h3-7,17H,8H2,1-2H3,(H,13,14)
InChIKeyOHMURGPVYBXDKY-UHFFFAOYSA-N
XLogP0.70
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3,4-difluoro-N-[(5-methylpyrazin-2-yl)methyl]benzenesulfonamide
CID 3829331
2-(methylamino)-N-(pyridazin-3-ylmethyl)pyridine-4-sulfonamide
CID 106897636
N-[(4-chlorophenyl)methyl]-2-(methylamino)pyridine-4-sulfonamide
CID 62164890
N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62148302
4-(bromomethyl)-N-[(5-methylpyrazin-2-yl)methyl]benzenesulfonamide
CID 65479645
N-[(2-methoxyphenyl)methyl]-2-(methylamino)pyridine-4-sulfonamide
CID 62164415
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-2-(methylamino)pyridine-4-sulfonamide
CID 106304083
N-[2-[[2-(methylamino)-4-pyridinyl]sulfonylamino]ethyl]acetamide
CID 62145904
2,4-dibromo-N-[(5-methylpyrazin-2-yl)methyl]benzenesulfonamide
CID 62839999
N-cyclobutyl-2-(methylamino)pyridine-4-sulfonamide
CID 62414070
2-fluoro-N-[(5-methylpyrazin-2-yl)methyl]benzenesulfonamide
CID 62847397
2-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-4-sulfonamide
CID 55043942

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide?
The IUPAC name of 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide (CID 62840002) is 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide is CNc1cc(S(=O)(=O)NCc2cnc(C)cn2)ccn1.
What is the InChIKey of 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide?
The InChIKey is OHMURGPVYBXDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2S/c1-9-6-16-10(7-15-9)8-17-20(18,19)11-3-4-14-12(5-11)13-2/h3-7,17H,8H2,1-2H3,(H,13,14).
What are the key properties of 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide?
2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide has a molecular weight of 293.35 g/mol, XLogP of 0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-sulfonamide is sourced from PubChem (CID 62840002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).