N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide

C15H19N3O2S — CID 62146204

IUPACN-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide
SMILESCCN(c1cccc(C)c1)S(=O)(=O)c1ccnc(NC)c1
InChIInChI=1S/C15H19N3O2S/c1-4-18(13-7-5-6-12(2)10-13)21(19,20)14-8-9-17-15(11-14)16-3/h5-11H,4H2,1-3H3,(H,16,17)
InChIKeyAHTHXLCSRLCOLR-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.65
Rot. Bonds5

About N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide

N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide (PubChem CID 62146204) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide
PubChem CID62146204
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide
SMILESCCN(c1cccc(C)c1)S(=O)(=O)c1ccnc(NC)c1
InChIInChI=1S/C15H19N3O2S/c1-4-18(13-7-5-6-12(2)10-13)21(19,20)14-8-9-17-15(11-14)16-3/h5-11H,4H2,1-3H3,(H,16,17)
InChIKeyAHTHXLCSRLCOLR-UHFFFAOYSA-N
XLogP2.65
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(methylamino)-N-propylpyridine-4-sulfonamide
CID 62144437
N-ethyl-4-(2-methylbutan-2-yl)-N-(3-methylphenyl)benzenesulfonamide
CID 3672777
N-(3-fluorophenyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62157049
4-acetyl-N-ethyl-N-(3-methylphenyl)benzenesulfonamide
CID 5180970
N-ethyl-N-(3-methylphenyl)-4-(trifluoromethyl)benzenesulfonamide
CID 3835730
2-amino-N-ethyl-N-(4-methylphenyl)pyridine-4-sulfonamide
CID 62158760
N-cyclopropyl-2-(methylamino)-N-propylpyridine-4-sulfonamide
CID 62144804
N-(3-methoxyphenyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62158204
4-[(N,3-dimethylanilino)methyl]-N-methylpyridin-2-amine
CID 62470893
N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62146541
N-butyl-3-[ethyl-(3-methylphenyl)sulfamoyl]-N-methylbenzamide
CID 109065532
4-[ethyl-(3-methylphenyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 109058243

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
The IUPAC name of N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide (CID 62146204) is N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide.
What is the SMILES notation for N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
The canonical SMILES for N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide is CCN(c1cccc(C)c1)S(=O)(=O)c1ccnc(NC)c1.
What is the InChIKey of N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
The InChIKey is AHTHXLCSRLCOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-4-18(13-7-5-6-12(2)10-13)21(19,20)14-8-9-17-15(11-14)16-3/h5-11H,4H2,1-3H3,(H,16,17).
What are the key properties of N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide?
N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide has a molecular weight of 305.40 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(methylamino)-N-(3-methylphenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 62146204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).