2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide

C10H8Cl2N4O2S — CID 65489476

IUPAC2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide
SMILESCc1ccnc(Cl)c1NS(=O)(=O)c1cnc(Cl)nc1
InChIInChI=1S/C10H8Cl2N4O2S/c1-6-2-3-13-9(11)8(6)16-19(17,18)7-4-14-10(12)15-5-7/h2-5,16H,1H3
InChIKeyANAXXJQGITVKRH-UHFFFAOYSA-N
MW319.17 g/mol
LogP2.29
Rot. Bonds3

About 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide

2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide (PubChem CID 65489476) has the molecular formula C10H8Cl2N4O2S and a molecular weight of 319.17 g/mol. Its IUPAC name is 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide
PubChem CID65489476
Molecular FormulaC10H8Cl2N4O2S
Molecular Weight319.17 g/mol
Exact Mass317.97
IUPAC Name2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide
SMILESCc1ccnc(Cl)c1NS(=O)(=O)c1cnc(Cl)nc1
InChIInChI=1S/C10H8Cl2N4O2S/c1-6-2-3-13-9(11)8(6)16-19(17,18)7-4-14-10(12)15-5-7/h2-5,16H,1H3
InChIKeyANAXXJQGITVKRH-UHFFFAOYSA-N
XLogP2.29
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.17
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-(2-chloro-4-methyl-3-pyridinyl)-4-methylbenzenesulfonamide
CID 65491849
3-amino-N-(2-chloro-4-methyl-3-pyridinyl)benzenesulfonamide
CID 65488884
2-chloro-N-(2-ethyl-6-methylphenyl)pyrimidine-5-sulfonamide
CID 43456385
4-amino-3-bromo-N-(2-chloro-4-methyl-3-pyridinyl)benzenesulfonamide
CID 65489469
2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)ethanesulfonamide
CID 107652106
2-amino-4-bromo-N-(2-chloro-4-methyl-3-pyridinyl)benzenesulfonamide
CID 65490667
2,5-dichloro-N-(2-chloro-4-methyl-3-pyridinyl)thiophene-3-sulfonamide
CID 114051247
2-chloro-N-(4-chloro-2-pyridinyl)pyrimidine-5-sulfonamide
CID 114052244
5-[(2-chloro-4-methyl-3-pyridinyl)sulfamoyl]-3-methylthiophene-2-carboxylic acid
CID 65489280
N-(5-bromo-2-methylphenyl)-2-chloropyrimidine-5-sulfonamide
CID 43805950
2-amino-5-chloro-N-(2-chloro-4-methyl-3-pyridinyl)benzenesulfonamide
CID 65491458
2-chloro-N-(3,5-dimethylphenyl)pyrimidine-5-sulfonamide
CID 43456340

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide (CID 65489476) is 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide is Cc1ccnc(Cl)c1NS(=O)(=O)c1cnc(Cl)nc1.
What is the InChIKey of 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide?
The InChIKey is ANAXXJQGITVKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N4O2S/c1-6-2-3-13-9(11)8(6)16-19(17,18)7-4-14-10(12)15-5-7/h2-5,16H,1H3.
What are the key properties of 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide?
2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide has a molecular weight of 319.17 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-chloro-4-methyl-3-pyridinyl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 65489476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).