2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide

C11H19N3O2S — CID 62143940

IUPAC2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide
SMILESCCC(C)CN(C)S(=O)(=O)c1ccnc(N)c1
InChIInChI=1S/C11H19N3O2S/c1-4-9(2)8-14(3)17(15,16)10-5-6-13-11(12)7-10/h5-7,9H,4,8H2,1-3H3,(H2,12,13)
InChIKeyHJBSYLKKERXWJZ-UHFFFAOYSA-N
MW257.36 g/mol
LogP1.33
Rot. Bonds5

About 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide

2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide (PubChem CID 62143940) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide
PubChem CID62143940
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC Name2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide
SMILESCCC(C)CN(C)S(=O)(=O)c1ccnc(N)c1
InChIInChI=1S/C11H19N3O2S/c1-4-9(2)8-14(3)17(15,16)10-5-6-13-11(12)7-10/h5-7,9H,4,8H2,1-3H3,(H2,12,13)
InChIKeyHJBSYLKKERXWJZ-UHFFFAOYSA-N
XLogP1.33
TPSA76.29 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 ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N,4-dimethyl-N-(2-methylbutyl)benzenesulfonamide
CID 43295498
3-amino-4-methoxy-N-methyl-N-(2-methylbutyl)benzenesulfonamide
CID 43295497
3-hydroxy-N-methyl-N-(2-methylbutyl)benzenesulfonamide
CID 81259126
4-(aminomethyl)-N-methyl-N-(2-methylbutyl)benzenesulfonamide
CID 43295859
2-amino-N-ethyl-N-(1-methoxypropan-2-yl)pyridine-4-sulfonamide
CID 55043601
2-hydrazinyl-N-methyl-N-(2-methylpropyl)pyridine-4-sulfonamide
CID 61003232
2-amino-N-butan-2-yl-N-(2-methoxyethyl)pyridine-4-sulfonamide
CID 62151483
2-amino-N-[2-(dimethylamino)ethyl]-N-propylpyridine-4-sulfonamide
CID 62159378
2-(aminomethyl)-N-methyl-N-(2-methylbutyl)pyridine-3-sulfonamide
CID 106593839
4-hydrazinyl-N-methyl-N-(2-methylbutyl)-3-nitrobenzenesulfonamide
CID 43296192
4-amino-2,6-dibromo-N-methyl-N-(2-methylbutyl)benzenesulfonamide
CID 43295470
3-chloro-N-methyl-4-(methylaminomethyl)-N-(2-methylbutyl)benzenesulfonamide
CID 107091254

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide?
The IUPAC name of 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide (CID 62143940) is 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide is CCC(C)CN(C)S(=O)(=O)c1ccnc(N)c1.
What is the InChIKey of 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide?
The InChIKey is HJBSYLKKERXWJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-4-9(2)8-14(3)17(15,16)10-5-6-13-11(12)7-10/h5-7,9H,4,8H2,1-3H3,(H2,12,13).
What are the key properties of 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide?
2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide has a molecular weight of 257.36 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(2-methylbutyl)pyridine-4-sulfonamide is sourced from PubChem (CID 62143940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).