N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide

C10H10ClN3O2S — CID 66254277

IUPACN-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide
SMILESCc1cccc(Cl)c1NS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C10H10ClN3O2S/c1-7-3-2-4-9(11)10(7)14-17(15,16)8-5-12-13-6-8/h2-6,14H,1H3,(H,12,13)
InChIKeyGQHOBXBHLYNIKG-UHFFFAOYSA-N
MW271.73 g/mol
LogP2.17
Rot. Bonds3

About N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide

N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide (PubChem CID 66254277) has the molecular formula C10H10ClN3O2S and a molecular weight of 271.73 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide
PubChem CID66254277
Molecular FormulaC10H10ClN3O2S
Molecular Weight271.73 g/mol
Exact Mass271.02
IUPAC NameN-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide
SMILESCc1cccc(Cl)c1NS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C10H10ClN3O2S/c1-7-3-2-4-9(11)10(7)14-17(15,16)8-5-12-13-6-8/h2-6,14H,1H3,(H,12,13)
InChIKeyGQHOBXBHLYNIKG-UHFFFAOYSA-N
XLogP2.17
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.73
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-6-methylphenyl)-1H-pyrazole-4-sulfonamide
CID 54909805
N-(2-ethyl-6-methylphenyl)-1H-pyrazole-4-sulfonamide
CID 47267507
N-(2-chloro-6-methylphenyl)-4-methylbenzenesulfonamide
CID 19256835
N-(2-chloro-6-methylphenyl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 66257339
N-(2-chloro-6-methylphenyl)-4-hydrazinylbenzenesulfonamide
CID 66255534
N-(2-hydroxy-6-methoxyphenyl)-1H-pyrazole-4-sulfonamide
CID 114764727
N-(5-amino-2-methylphenyl)-1H-pyrazole-4-sulfonamide
CID 54937299
N-(2,4-dichlorophenyl)-1H-pyrazole-4-sulfonamide
CID 47267509
N-(2-chloro-6-methylphenyl)-4-cyanobenzenesulfonamide
CID 66254566
N-(2-chloro-4-iodophenyl)-1H-pyrazole-4-sulfonamide
CID 47364015
N-[(2-chlorophenyl)methyl]-1H-pyrazole-4-sulfonamide
CID 54934551
N-(3-methylsulfonylphenyl)-1H-pyrazole-4-sulfonamide
CID 47267601

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide (CID 66254277) is N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide is Cc1cccc(Cl)c1NS(=O)(=O)c1cn[nH]c1.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is GQHOBXBHLYNIKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O2S/c1-7-3-2-4-9(11)10(7)14-17(15,16)8-5-12-13-6-8/h2-6,14H,1H3,(H,12,13).
What are the key properties of N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide?
N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 271.73 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 66254277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).