6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide

C12H14N4O2S — CID 79240478

IUPAC6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide
SMILESCNc1ccc(S(=O)(=O)Nc2ccnc(C)c2)cn1
InChIInChI=1S/C12H14N4O2S/c1-9-7-10(5-6-14-9)16-19(17,18)11-3-4-12(13-2)15-8-11/h3-8H,1-2H3,(H,13,15)(H,14,16)
InChIKeyDLGOYMGLHFKTFW-UHFFFAOYSA-N
MW278.34 g/mol
LogP1.63
Rot. Bonds4

About 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide

6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide (PubChem CID 79240478) has the molecular formula C12H14N4O2S and a molecular weight of 278.34 g/mol. Its IUPAC name is 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide
PubChem CID79240478
Molecular FormulaC12H14N4O2S
Molecular Weight278.34 g/mol
Exact Mass278.08
IUPAC Name6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide
SMILESCNc1ccc(S(=O)(=O)Nc2ccnc(C)c2)cn1
InChIInChI=1S/C12H14N4O2S/c1-9-7-10(5-6-14-9)16-19(17,18)11-3-4-12(13-2)15-8-11/h3-8H,1-2H3,(H,13,15)(H,14,16)
InChIKeyDLGOYMGLHFKTFW-UHFFFAOYSA-N
XLogP1.63
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.34
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide?
The IUPAC name of 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide (CID 79240478) is 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide is CNc1ccc(S(=O)(=O)Nc2ccnc(C)c2)cn1.
What is the InChIKey of 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide?
The InChIKey is DLGOYMGLHFKTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2S/c1-9-7-10(5-6-14-9)16-19(17,18)11-3-4-12(13-2)15-8-11/h3-8H,1-2H3,(H,13,15)(H,14,16).
What are the key properties of 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide?
6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide has a molecular weight of 278.34 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-3-sulfonamide is sourced from PubChem (CID 79240478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).