4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide

C15H15N3O2S — CID 169370772

IUPAC4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cccc3cn(C)nc23)cc1
InChIInChI=1S/C15H15N3O2S/c1-11-6-8-13(9-7-11)21(19,20)17-14-5-3-4-12-10-18(2)16-15(12)14/h3-10,17H,1-2H3
InChIKeyPDMIUDQHDLVJQA-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.68
Rot. Bonds3

About 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide

4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide (PubChem CID 169370772) has the molecular formula C15H15N3O2S and a molecular weight of 301.37 g/mol. Its IUPAC name is 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide
PubChem CID169370772
Molecular FormulaC15H15N3O2S
Molecular Weight301.37 g/mol
Exact Mass301.09
IUPAC Name4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cccc3cn(C)nc23)cc1
InChIInChI=1S/C15H15N3O2S/c1-11-6-8-13(9-7-11)21(19,20)17-14-5-3-4-12-10-18(2)16-15(12)14/h3-10,17H,1-2H3
InChIKeyPDMIUDQHDLVJQA-UHFFFAOYSA-N
XLogP2.68
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[2-[2-[(4-methylphenyl)sulfonylamino]phenyl]phenyl]benzenesulfonamide
CID 1010988
4-methyl-N-(2-methyl-1,3-benzoxazol-4-yl)benzenesulfonamide
CID 169371778
N-[1-(4-methylphenyl)sulfonylbenzotriazol-4-yl]benzenesulfonamide
CID 15122288
N-[3-hydroxy-2-[(4-methylphenyl)sulfonylamino]phenyl]-4-methylbenzenesulfonamide
CID 70133555
4-methyl-N-[2-(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)phenyl]benzenesulfonamide
CID 101406239
4-bromo-N-(1,3-dimethylpyrazol-4-yl)benzenesulfonamide
CID 22209076
N-(2-formyl-3-methylphenyl)-4-methylbenzenesulfonamide
CID 132937124
1,3-bis[2-[(4-methylphenyl)sulfonylamino]phenyl]urea
CID 170548847
4-methyl-N-[2-[[2-[(4-methylphenyl)sulfonylamino]phenyl]diazenyl]phenyl]benzenesulfonamide
CID 102274853
N-(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)-4-methylbenzenesulfonamide
CID 134838868
N-(8-hydroxyquinolin-3-yl)-4-methylbenzenesulfonamide
CID 22674101
4-methyl-N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]benzenesulfonamide
CID 17444200

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide?
The IUPAC name of 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide (CID 169370772) is 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide?
The canonical SMILES for 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2cccc3cn(C)nc23)cc1.
What is the InChIKey of 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide?
The InChIKey is PDMIUDQHDLVJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S/c1-11-6-8-13(9-7-11)21(19,20)17-14-5-3-4-12-10-18(2)16-15(12)14/h3-10,17H,1-2H3.
What are the key properties of 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide?
4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide has a molecular weight of 301.37 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylindazol-7-yl)benzenesulfonamide is sourced from PubChem (CID 169370772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).