2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide

C12H11ClN2O2S — CID 5147339

IUPAC2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide
SMILESCc1cccnc1NS(=O)(=O)c1ccccc1Cl
InChIInChI=1S/C12H11ClN2O2S/c1-9-5-4-8-14-12(9)15-18(16,17)11-7-3-2-6-10(11)13/h2-8H,1H3,(H,14,15)
InChIKeyONWRLLUWNRJFFH-UHFFFAOYSA-N
MW282.75 g/mol
LogP2.84
Rot. Bonds3

About 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide

2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide (PubChem CID 5147339) has the molecular formula C12H11ClN2O2S and a molecular weight of 282.75 g/mol. Its IUPAC name is 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide
PubChem CID5147339
Molecular FormulaC12H11ClN2O2S
Molecular Weight282.75 g/mol
Exact Mass282.02
IUPAC Name2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide
SMILESCc1cccnc1NS(=O)(=O)c1ccccc1Cl
InChIInChI=1S/C12H11ClN2O2S/c1-9-5-4-8-14-12(9)15-18(16,17)11-7-3-2-6-10(11)13/h2-8H,1H3,(H,14,15)
InChIKeyONWRLLUWNRJFFH-UHFFFAOYSA-N
XLogP2.84
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.75
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4,5-trichloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 19683104
2-[(2-chlorophenyl)sulfonylamino]pyridine-3-carboxylic acid
CID 4738922
N-(3-chloropyrazin-2-yl)-2-methylbenzenesulfonamide
CID 102990036
N-(3-chloro-2-pyridinyl)-2-(methylaminomethyl)benzenesulfonamide
CID 106086657
2,5-dimethyl-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 15944002
4-iodo-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 3792615
5-bromo-2,4-dimethyl-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 45100413
3-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 25043050
N-(3-chloro-2-pyridinyl)-2-(propylamino)pyridine-3-sulfonamide
CID 103094788
2-chloro-N-(3-chloro-6,7-dimethylquinoxalin-2-yl)benzenesulfonamide
CID 86657925
2-(methylamino)-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 62144229
3-amino-N-(3-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303464

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide (CID 5147339) is 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide is Cc1cccnc1NS(=O)(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide?
The InChIKey is ONWRLLUWNRJFFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2S/c1-9-5-4-8-14-12(9)15-18(16,17)11-7-3-2-6-10(11)13/h2-8H,1H3,(H,14,15).
What are the key properties of 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide?
2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide has a molecular weight of 282.75 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 5147339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).