N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide

C11H19N3O2S — CID 133304050

IUPACN-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide
SMILESCNS(=O)(=O)c1ccc(N(C)CC(C)C)nc1
InChIInChI=1S/C11H19N3O2S/c1-9(2)8-14(4)11-6-5-10(7-13-11)17(15,16)12-3/h5-7,9,12H,8H2,1-4H3
InChIKeyWMOSHHDDYXAOHY-UHFFFAOYSA-N
MW257.36 g/mol
LogP1.08
Rot. Bonds5

About N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide

N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide (PubChem CID 133304050) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide
PubChem CID133304050
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC NameN-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide
SMILESCNS(=O)(=O)c1ccc(N(C)CC(C)C)nc1
InChIInChI=1S/C11H19N3O2S/c1-9(2)8-14(4)11-6-5-10(7-13-11)17(15,16)12-3/h5-7,9,12H,8H2,1-4H3
InChIKeyWMOSHHDDYXAOHY-UHFFFAOYSA-N
XLogP1.08
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide?
The IUPAC name of N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide (CID 133304050) is N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide.
What is the SMILES notation for N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide?
The canonical SMILES for N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide is CNS(=O)(=O)c1ccc(N(C)CC(C)C)nc1.
What is the InChIKey of N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide?
The InChIKey is WMOSHHDDYXAOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-9(2)8-14(4)11-6-5-10(7-13-11)17(15,16)12-3/h5-7,9,12H,8H2,1-4H3.
What are the key properties of N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide?
N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide has a molecular weight of 257.36 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[methyl(2-methylpropyl)amino]pyridine-3-sulfonamide is sourced from PubChem (CID 133304050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).