2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide

C10H17N3O2S — CID 115274638

IUPAC2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide
SMILESCNc1ccc(NS(=O)(=O)C(C)(C)C)cn1
InChIInChI=1S/C10H17N3O2S/c1-10(2,3)16(14,15)13-8-5-6-9(11-4)12-7-8/h5-7,13H,1-4H3,(H,11,12)
InChIKeyOAJCFGLWGRFENZ-UHFFFAOYSA-N
MW243.33 g/mol
LogP1.66
Rot. Bonds3

About 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide

2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide (PubChem CID 115274638) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide
PubChem CID115274638
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC Name2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide
SMILESCNc1ccc(NS(=O)(=O)C(C)(C)C)cn1
InChIInChI=1S/C10H17N3O2S/c1-10(2,3)16(14,15)13-8-5-6-9(11-4)12-7-8/h5-7,13H,1-4H3,(H,11,12)
InChIKeyOAJCFGLWGRFENZ-UHFFFAOYSA-N
XLogP1.66
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide?
The IUPAC name of 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide (CID 115274638) is 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide.
What is the SMILES notation for 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide?
The canonical SMILES for 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide is CNc1ccc(NS(=O)(=O)C(C)(C)C)cn1.
What is the InChIKey of 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide?
The InChIKey is OAJCFGLWGRFENZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c1-10(2,3)16(14,15)13-8-5-6-9(11-4)12-7-8/h5-7,13H,1-4H3,(H,11,12).
What are the key properties of 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide?
2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide has a molecular weight of 243.33 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[6-(methylamino)-3-pyridinyl]propane-2-sulfonamide is sourced from PubChem (CID 115274638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).