6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide

C13H13Cl2N3O2S — CID 5267654

IUPAC6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(Nc2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C13H13Cl2N3O2S/c1-18(2)21(19,20)10-4-6-13(16-8-10)17-12-7-9(14)3-5-11(12)15/h3-8H,1-2H3,(H,16,17)
InChIKeyZZENELSSKFULBH-UHFFFAOYSA-N
MW346.24 g/mol
LogP3.38
Rot. Bonds4

About 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide

6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide (PubChem CID 5267654) has the molecular formula C13H13Cl2N3O2S and a molecular weight of 346.24 g/mol. Its IUPAC name is 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide
PubChem CID5267654
Molecular FormulaC13H13Cl2N3O2S
Molecular Weight346.24 g/mol
Exact Mass345.01
IUPAC Name6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(Nc2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C13H13Cl2N3O2S/c1-18(2)21(19,20)10-4-6-13(16-8-10)17-12-7-9(14)3-5-11(12)15/h3-8H,1-2H3,(H,16,17)
InChIKeyZZENELSSKFULBH-UHFFFAOYSA-N
XLogP3.38
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.24
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-chloro-2-methylanilino)-N,N-di(propan-2-yl)pyridine-3-sulfonamide
CID 5267817
6-(2-methoxy-5-methylanilino)-N,N-dimethylpyridine-3-sulfonamide
CID 5267586
4-N-(2-chloro-5-ethylsulfonylphenyl)-6-N-(5-chloro-2-pyridinyl)pyrimidine-4,6-diamine
CID 147755411
6-(4-chloro-2-methylanilino)-N-ethyl-N-phenylpyridine-3-sulfonamide
CID 5268362
[[4-chloro-3-[[6-[(5-chloro-2-pyridinyl)amino]pyrimidin-4-yl]amino]phenyl]sulfonyl-methylamino] 2,2,2-trifluoroacetate
CID 89307016
N-(4-chloro-2-methylphenyl)-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 5268142
6-(4-acetylanilino)-N,N-dimethylpyridine-3-sulfonamide
CID 5267682
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2-chloro-5-(dimethylsulfamoyl)benzoate
CID 2648905
6-[(2-methoxy-2-methylpropyl)amino]-N,N-dimethylpyridine-3-sulfonamide
CID 103704076
N-(2,5-dichlorophenyl)-4-(dimethylsulfamoyl)thiophene-2-carboxamide
CID 6503075
6-(4-ethoxyanilino)-N,N-dimethylpyridine-3-sulfonamide
CID 5267681
2-N-(2,5-dichlorophenyl)pyrazine-2,5-diamine
CID 80652884

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide?
The IUPAC name of 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide (CID 5267654) is 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide.
What is the SMILES notation for 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide?
The canonical SMILES for 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide is CN(C)S(=O)(=O)c1ccc(Nc2cc(Cl)ccc2Cl)nc1.
What is the InChIKey of 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide?
The InChIKey is ZZENELSSKFULBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13Cl2N3O2S/c1-18(2)21(19,20)10-4-6-13(16-8-10)17-12-7-9(14)3-5-11(12)15/h3-8H,1-2H3,(H,16,17).
What are the key properties of 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide?
6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide has a molecular weight of 346.24 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dichloroanilino)-N,N-dimethylpyridine-3-sulfonamide is sourced from PubChem (CID 5267654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).