N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide

C10H9Cl2N3O2S — CID 114051197

IUPACN-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide
SMILESCc1cc(Cl)nc(Cl)c1NS(=O)(=O)c1cc[nH]c1
InChIInChI=1S/C10H9Cl2N3O2S/c1-6-4-8(11)14-10(12)9(6)15-18(16,17)7-2-3-13-5-7/h2-5,13,15H,1H3
InChIKeyYSOFWRAWPUWLJI-UHFFFAOYSA-N
MW306.17 g/mol
LogP2.83
Rot. Bonds3

About N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide

N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide (PubChem CID 114051197) has the molecular formula C10H9Cl2N3O2S and a molecular weight of 306.17 g/mol. Its IUPAC name is N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide.

Molecular Properties

Compound NameN-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide
PubChem CID114051197
Molecular FormulaC10H9Cl2N3O2S
Molecular Weight306.17 g/mol
Exact Mass304.98
IUPAC NameN-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide
SMILESCc1cc(Cl)nc(Cl)c1NS(=O)(=O)c1cc[nH]c1
InChIInChI=1S/C10H9Cl2N3O2S/c1-6-4-8(11)14-10(12)9(6)15-18(16,17)7-2-3-13-5-7/h2-5,13,15H,1H3
InChIKeyYSOFWRAWPUWLJI-UHFFFAOYSA-N
XLogP2.83
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.17
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-dichloro-4-methyl-3-pyridinyl)-1-methylpyrazole-4-sulfonamide
CID 114051204
N-(2,6-dichloro-4-methyl-3-pyridinyl)cyclopentanesulfonamide
CID 114051214
3-[(2,6-dichloro-4-methyl-3-pyridinyl)sulfamoyl]propanoic acid
CID 114051258
5-methyl-2-(1H-pyrrol-3-ylsulfonylamino)benzoic acid
CID 43294353
N-(2,6-dichloro-4-methyl-3-pyridinyl)-2-methylpyrazole-3-carboxamide
CID 114051088
4-chloro-N-(4-chloro-2,6-dimethylphenyl)benzenesulfonamide
CID 4600723
5-chloro-2-methoxy-4-(1H-pyrrol-3-ylsulfonylamino)benzoic acid
CID 43614478
N-(4-chloro-2,6-dimethylphenyl)benzenesulfonamide
CID 3370012
2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide
CID 65489476
N-(2,6-dichloro-4-methyl-3-pyridinyl)-4-propan-2-ylbenzamide
CID 103738285
2-chloro-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-4-sulfonamide
CID 61053156
3-amino-N-(2-chloro-4-methyl-3-pyridinyl)-4-methylbenzenesulfonamide
CID 65491849

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide?
The IUPAC name of N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide (CID 114051197) is N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide.
What is the SMILES notation for N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide?
The canonical SMILES for N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide is Cc1cc(Cl)nc(Cl)c1NS(=O)(=O)c1cc[nH]c1.
What is the InChIKey of N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide?
The InChIKey is YSOFWRAWPUWLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N3O2S/c1-6-4-8(11)14-10(12)9(6)15-18(16,17)7-2-3-13-5-7/h2-5,13,15H,1H3.
What are the key properties of N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide?
N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide has a molecular weight of 306.17 g/mol, XLogP of 2.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloro-4-methyl-3-pyridinyl)-1H-pyrrole-3-sulfonamide is sourced from PubChem (CID 114051197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).