2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide

C11H14N4O2S2 — CID 62156810

IUPAC2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NCc1cnc(C)s1
InChIInChI=1S/C11H14N4O2S2/c1-8-14-6-9(18-8)7-15-19(16,17)10-4-3-5-13-11(10)12-2/h3-6,15H,7H2,1-2H3,(H,12,13)
InChIKeyVRSQASLGYUANJM-UHFFFAOYSA-N
MW298.39 g/mol
LogP1.37
Rot. Bonds5

About 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide

2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide (PubChem CID 62156810) has the molecular formula C11H14N4O2S2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide
PubChem CID62156810
Molecular FormulaC11H14N4O2S2
Molecular Weight298.39 g/mol
Exact Mass298.06
IUPAC Name2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NCc1cnc(C)s1
InChIInChI=1S/C11H14N4O2S2/c1-8-14-6-9(18-8)7-15-19(16,17)10-4-3-5-13-11(10)12-2/h3-6,15H,7H2,1-2H3,(H,12,13)
InChIKeyVRSQASLGYUANJM-UHFFFAOYSA-N
XLogP1.37
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-ethylphenyl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 106900712
2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
CID 63247729
2-(methylamino)-N-[(3-methylphenyl)methyl]pyridine-3-sulfonamide
CID 62146869
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 106049652
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1H-pyrazole-5-sulfonamide
CID 102692815
N-[(4-chlorophenyl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 62164717
2,5-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]thiophene-3-sulfonamide
CID 86839289
2-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-2,3-diamine
CID 61282550
2-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 62149939
N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanesulfonamide
CID 61384794
2-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-sulfonamide
CID 80524392
2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide
CID 79356890

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide?
The IUPAC name of 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide (CID 62156810) is 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide is CNc1ncccc1S(=O)(=O)NCc1cnc(C)s1.
What is the InChIKey of 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide?
The InChIKey is VRSQASLGYUANJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S2/c1-8-14-6-9(18-8)7-15-19(16,17)10-4-3-5-13-11(10)12-2/h3-6,15H,7H2,1-2H3,(H,12,13).
What are the key properties of 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide?
2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide has a molecular weight of 298.39 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 62156810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).