N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide

C15H14N4O3S — CID 53476532

IUPACN-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
SMILESCC(=O)Nc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1
InChIInChI=1S/C15H14N4O3S/c1-9(20)17-11-5-6-14-13(8-11)15(19-18-14)10-3-2-4-12(7-10)23(16,21)22/h2-8H,1H3,(H,17,20)(H,18,19)(H2,16,21,22)
InChIKeyWJMWEDMHIXNQSH-UHFFFAOYSA-N
MW330.37 g/mol
LogP1.84
Rot. Bonds3

About N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide

N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide (PubChem CID 53476532) has the molecular formula C15H14N4O3S and a molecular weight of 330.37 g/mol. Its IUPAC name is N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide.

Molecular Properties

Compound NameN-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
PubChem CID53476532
Molecular FormulaC15H14N4O3S
Molecular Weight330.37 g/mol
Exact Mass330.08
IUPAC NameN-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide
SMILESCC(=O)Nc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1
InChIInChI=1S/C15H14N4O3S/c1-9(20)17-11-5-6-14-13(8-11)15(19-18-14)10-3-2-4-12(7-10)23(16,21)22/h2-8H,1H3,(H,17,20)(H,18,19)(H2,16,21,22)
InChIKeyWJMWEDMHIXNQSH-UHFFFAOYSA-N
XLogP1.84
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
The IUPAC name of N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide (CID 53476532) is N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide.
What is the SMILES notation for N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
The canonical SMILES for N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide is CC(=O)Nc1ccc2[nH]nc(-c3cccc(S(N)(=O)=O)c3)c2c1.
What is the InChIKey of N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
The InChIKey is WJMWEDMHIXNQSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3S/c1-9(20)17-11-5-6-14-13(8-11)15(19-18-14)10-3-2-4-12(7-10)23(16,21)22/h2-8H,1H3,(H,17,20)(H,18,19)(H2,16,21,22).
What are the key properties of N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide?
N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide has a molecular weight of 330.37 g/mol, XLogP of 1.84, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-sulfamoylphenyl)-1H-indazol-5-yl]acetamide is sourced from PubChem (CID 53476532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).