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

C12H14N4O2S — CID 103303467

IUPAC3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1cccc(C)n1
InChIInChI=1S/C12H14N4O2S/c1-9-5-3-7-11(15-9)16-19(17,18)12-10(13-2)6-4-8-14-12/h3-8,13H,1-2H3,(H,15,16)
InChIKeyZCFVBPUUOQXDFU-UHFFFAOYSA-N
MW278.34 g/mol
LogP1.63
Rot. Bonds4

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

3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide (PubChem CID 103303467) has the molecular formula C12H14N4O2S and a molecular weight of 278.34 g/mol. Its IUPAC name is 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
PubChem CID103303467
Molecular FormulaC12H14N4O2S
Molecular Weight278.34 g/mol
Exact Mass278.08
IUPAC Name3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1cccc(C)n1
InChIInChI=1S/C12H14N4O2S/c1-9-5-3-7-11(15-9)16-19(17,18)12-10(13-2)6-4-8-14-12/h3-8,13H,1-2H3,(H,15,16)
InChIKeyZCFVBPUUOQXDFU-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 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide?
The IUPAC name of 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide (CID 103303467) is 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide?
The canonical SMILES for 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide is CNc1cccnc1S(=O)(=O)Nc1cccc(C)n1.
What is the InChIKey of 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide?
The InChIKey is ZCFVBPUUOQXDFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2S/c1-9-5-3-7-11(15-9)16-19(17,18)12-10(13-2)6-4-8-14-12/h3-8,13H,1-2H3,(H,15,16).
What are the key properties of 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide?
3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-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 3-(methylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide is sourced from PubChem (CID 103303467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).