N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide

C14H13N3O3S — CID 2078537

IUPACN-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C14H13N3O3S/c1-20-13-4-2-3-5-14(13)21(18,19)17-11-7-6-10-9-15-16-12(10)8-11/h2-9,17H,1H3,(H,15,16)
InChIKeyUBRISLCRQPOLTP-UHFFFAOYSA-N
MW303.34 g/mol
LogP2.37
Rot. Bonds4

About N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide

N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide (PubChem CID 2078537) has the molecular formula C14H13N3O3S and a molecular weight of 303.34 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide
PubChem CID2078537
Molecular FormulaC14H13N3O3S
Molecular Weight303.34 g/mol
Exact Mass303.07
IUPAC NameN-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C14H13N3O3S/c1-20-13-4-2-3-5-14(13)21(18,19)17-11-7-6-10-9-15-16-12(10)8-11/h2-9,17H,1H3,(H,15,16)
InChIKeyUBRISLCRQPOLTP-UHFFFAOYSA-N
XLogP2.37
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1H-indazol-6-ylsulfamoyl)-4-methoxybenzoic acid
CID 4844033
3-(5-methoxy-1H-indazol-3-yl)benzenesulfonamide
CID 53476531
4-chloro-N-(1H-indazol-6-yl)-3-methoxybenzenesulfonamide
CID 1507315
N-(1H-indazol-6-yl)-4-methoxy-3-methylbenzenesulfonamide
CID 1507316
4-ethoxy-N-1H-indazol-6-yl-2,5-dimethylbenzenesulfonamide
CID 2237144
N-(3-chloro-2H-indazol-4-yl)-4-methoxybenzenesulfonamide
CID 71459614
N-(1H-indazol-7-yl)-2,5-dimethoxy-4-methylbenzenesulfonamide
CID 5301628
(E)-3-[3-(1H-indazol-6-ylsulfamoyl)-4,5-dimethoxyphenyl]prop-2-enoic acid
CID 2480014
N-(1H-indazol-6-yl)-4-methoxy-3-nitrobenzenesulfonamide
CID 16280109
3-(4-methoxy-1H-indazol-3-yl)benzenesulfonamide
CID 118712911
N-(7-ethoxy-1H-indazol-4-yl)-4-methylbenzenesulfonamide
CID 53356004
4-methoxy-N-[4-(1H-pyrazol-4-yl)phenyl]benzenesulfonamide
CID 172453127

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide?
The IUPAC name of N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide (CID 2078537) is N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide.
What is the SMILES notation for N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide?
The canonical SMILES for N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide is COc1ccccc1S(=O)(=O)Nc1ccc2cn[nH]c2c1.
What is the InChIKey of N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide?
The InChIKey is UBRISLCRQPOLTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3S/c1-20-13-4-2-3-5-14(13)21(18,19)17-11-7-6-10-9-15-16-12(10)8-11/h2-9,17H,1H3,(H,15,16).
What are the key properties of N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide?
N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide has a molecular weight of 303.34 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)-2-methoxybenzenesulfonamide is sourced from PubChem (CID 2078537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).