N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide

C15H14N4O3S — CID 18447408

IUPACN-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide
SMILESNS(=O)(=O)c1ccc(CNC(=O)c2ccc3[nH]ncc3c2)cc1
InChIInChI=1S/C15H14N4O3S/c16-23(21,22)13-4-1-10(2-5-13)8-17-15(20)11-3-6-14-12(7-11)9-18-19-14/h1-7,9H,8H2,(H,17,20)(H,18,19)(H2,16,21,22)
InChIKeyQLTRMOKMFOLCBY-UHFFFAOYSA-N
MW330.37 g/mol
LogP1.14
Rot. Bonds4

About N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide

N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide (PubChem CID 18447408) has the molecular formula C15H14N4O3S and a molecular weight of 330.37 g/mol. Its IUPAC name is N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide
PubChem CID18447408
Molecular FormulaC15H14N4O3S
Molecular Weight330.37 g/mol
Exact Mass330.08
IUPAC NameN-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide
SMILESNS(=O)(=O)c1ccc(CNC(=O)c2ccc3[nH]ncc3c2)cc1
InChIInChI=1S/C15H14N4O3S/c16-23(21,22)13-4-1-10(2-5-13)8-17-15(20)11-3-6-14-12(7-11)9-18-19-14/h1-7,9H,8H2,(H,17,20)(H,18,19)(H2,16,21,22)
InChIKeyQLTRMOKMFOLCBY-UHFFFAOYSA-N
XLogP1.14
TPSA117.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-tert-butylphenyl)methyl]-1H-indazole-5-carboxamide
CID 22933798
N-(2-amino-2-oxoethyl)-1H-indazole-5-carboxamide
CID 63929072
2,6-dichloro-N-[(4-sulfamoylphenyl)methyl]pyridine-4-carboxamide
CID 84580537
4-fluoro-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 759573
1H-indazole-5-sulfonamide
CID 22567171
4-chloro-3-sulfamoyl-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 2566555
N-[(4-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
CID 46341632
2-oxo-N-[(4-sulfamoylphenyl)methyl]-3H-1,3-benzoxazole-5-carboxamide
CID 110766627
4-methoxy-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 3581074
3-(1H-indazole-5-carbonylamino)propanoic acid
CID 43354730
N-(2-phenylethyl)-1H-indazole-5-carboxamide
CID 22933558
2-methyl-N-[(4-sulfamoylphenyl)methyl]-1,3-benzoxazole-6-carboxamide
CID 77087766

Frequently Asked Questions

What is the IUPAC name of N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide?
The IUPAC name of N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide (CID 18447408) is N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide.
What is the SMILES notation for N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide?
The canonical SMILES for N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide is NS(=O)(=O)c1ccc(CNC(=O)c2ccc3[nH]ncc3c2)cc1.
What is the InChIKey of N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide?
The InChIKey is QLTRMOKMFOLCBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3S/c16-23(21,22)13-4-1-10(2-5-13)8-17-15(20)11-3-6-14-12(7-11)9-18-19-14/h1-7,9H,8H2,(H,17,20)(H,18,19)(H2,16,21,22).
What are the key properties of N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide?
N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide has a molecular weight of 330.37 g/mol, XLogP of 1.14, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-sulfamoylphenyl)methyl]-1H-indazole-5-carboxamide is sourced from PubChem (CID 18447408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).