N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide

C14H17N3O2S — CID 103304016

IUPACN-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1cc(C)cc(C)c1
InChIInChI=1S/C14H17N3O2S/c1-10-7-11(2)9-12(8-10)17-20(18,19)14-13(15-3)5-4-6-16-14/h4-9,15,17H,1-3H3
InChIKeySEIQXZJMADALNY-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.54
Rot. Bonds4

About N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide

N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide (PubChem CID 103304016) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide
PubChem CID103304016
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)Nc1cc(C)cc(C)c1
InChIInChI=1S/C14H17N3O2S/c1-10-7-11(2)9-12(8-10)17-20(18,19)14-13(15-3)5-4-6-16-14/h4-9,15,17H,1-3H3
InChIKeySEIQXZJMADALNY-UHFFFAOYSA-N
XLogP2.54
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethylphenyl)-3-hydrazinylpyridine-2-sulfonamide
CID 103300898
3-(methylamino)-N-(2,4,6-trimethylphenyl)pyridine-2-sulfonamide
CID 103303080
N-(2-chloro-4-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304236
3-(methylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303450
N-(3-fluoro-4-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304040
N-(5-bromo-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304876
N-(4-bromo-3-chlorophenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 107616509
N-(4,6-dimethylpyrimidin-2-yl)-3-(methylamino)pyridine-2-sulfonamide
CID 103303013
N-(4-methoxyphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103303586
N-(5-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103304023
N-(4-bromo-5-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103307734
N-(3-fluoro-2-methylphenyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305047

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide (CID 103304016) is N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide is CNc1cccnc1S(=O)(=O)Nc1cc(C)cc(C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide?
The InChIKey is SEIQXZJMADALNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-10-7-11(2)9-12(8-10)17-20(18,19)14-13(15-3)5-4-6-16-14/h4-9,15,17H,1-3H3.
What are the key properties of N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide?
N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide has a molecular weight of 291.38 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-3-(methylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103304016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).