N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide

C12H15N5O2S — CID 103303013

IUPACN-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1nc(C)cc(C)n1
InChIInChI=1S/C12H15N5O2S/c1-8-7-9(2)16-12(15-8)17-20(18,19)11-10(13-3)5-4-6-14-11/h4-7,13H,1-3H3,(H,15,16,17)
InChIKeyDBRDTTJRMMQZTJ-UHFFFAOYSA-N
MW293.35 g/mol
LogP1.33
Rot. Bonds4

About N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide

N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide (PubChem CID 103303013) has the molecular formula C12H15N5O2S and a molecular weight of 293.35 g/mol. Its IUPAC name is N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide
PubChem CID103303013
Molecular FormulaC12H15N5O2S
Molecular Weight293.35 g/mol
Exact Mass293.09
IUPAC NameN-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1nc(C)cc(C)n1
InChIInChI=1S/C12H15N5O2S/c1-8-7-9(2)16-12(15-8)17-20(18,19)11-10(13-3)5-4-6-14-11/h4-7,13H,1-3H3,(H,15,16,17)
InChIKeyDBRDTTJRMMQZTJ-UHFFFAOYSA-N
XLogP1.33
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(methylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303450
3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303467
N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304016
3-(methylamino)-N-(2,4,6-trimethylphenyl)pyridine-2-sulfonamide
CID 103303080
N-(5-bromo-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304876
N-(5-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304023
N-(2-chloro-4-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304236
N-(4,5-dimethyl-1,3-thiazol-2-yl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305616
N-(4-methoxyphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103303586
N-(3-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305047
N-(3-fluoro-4-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304040
N-(2,4-difluorophenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304009

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide (CID 103303013) is N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide is CNc1cccnc1S(=O)(=O)Nc1nc(C)cc(C)n1.
What is the InChIKey of N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide?
The InChIKey is DBRDTTJRMMQZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2S/c1-8-7-9(2)16-12(15-8)17-20(18,19)11-10(13-3)5-4-6-14-11/h4-7,13H,1-3H3,(H,15,16,17).
What are the key properties of N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide?
N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide has a molecular weight of 293.35 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103303013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).