N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide

C17H16N4O3S — CID 6539598

IUPACN-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
SMILESNS(=O)(=O)c1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)c1
InChIInChI=1S/C17H16N4O3S/c18-25(23,24)13-3-1-2-11(8-13)12-6-7-14-15(9-12)20-21-16(14)19-17(22)10-4-5-10/h1-3,6-10H,4-5H2,(H2,18,23,24)(H2,19,20,21,22)
InChIKeyAXXSVTAXFAAJTE-UHFFFAOYSA-N
MW356.41 g/mol
LogP2.23
Rot. Bonds4

About N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide

N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide (PubChem CID 6539598) has the molecular formula C17H16N4O3S and a molecular weight of 356.41 g/mol. Its IUPAC name is N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
PubChem CID6539598
Molecular FormulaC17H16N4O3S
Molecular Weight356.41 g/mol
Exact Mass356.09
IUPAC NameN-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
SMILESNS(=O)(=O)c1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)c1
InChIInChI=1S/C17H16N4O3S/c18-25(23,24)13-3-1-2-11(8-13)12-6-7-14-15(9-12)20-21-16(14)19-17(22)10-4-5-10/h1-3,6-10H,4-5H2,(H2,18,23,24)(H2,19,20,21,22)
InChIKeyAXXSVTAXFAAJTE-UHFFFAOYSA-N
XLogP2.23
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.41
LogP ≤ 52.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide (CID 6539598) is N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide is NS(=O)(=O)c1cccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)c1.
What is the InChIKey of N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide?
The InChIKey is AXXSVTAXFAAJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3S/c18-25(23,24)13-3-1-2-11(8-13)12-6-7-14-15(9-12)20-21-16(14)19-17(22)10-4-5-10/h1-3,6-10H,4-5H2,(H2,18,23,24)(H2,19,20,21,22).
What are the key properties of N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide?
N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide has a molecular weight of 356.41 g/mol, XLogP of 2.23, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 6539598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).