3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide

C21H16N4O3 — CID 142752240

IUPAC3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1ccc2[nH]nc(NC(=O)c3ccccc3)c2c1
InChIInChI=1S/C21H16N4O3/c26-16-8-4-7-15(12-16)22-21(28)14-9-10-18-17(11-14)19(25-24-18)23-20(27)13-5-2-1-3-6-13/h1-12,26H,(H,22,28)(H2,23,24,25,27)
InChIKeyPRUFGXHTQBGXCP-UHFFFAOYSA-N
MW372.38 g/mol
LogP3.77
Rot. Bonds4

About 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide

3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide (PubChem CID 142752240) has the molecular formula C21H16N4O3 and a molecular weight of 372.38 g/mol. Its IUPAC name is 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide
PubChem CID142752240
Molecular FormulaC21H16N4O3
Molecular Weight372.38 g/mol
Exact Mass372.12
IUPAC Name3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1ccc2[nH]nc(NC(=O)c3ccccc3)c2c1
InChIInChI=1S/C21H16N4O3/c26-16-8-4-7-15(12-16)22-21(28)14-9-10-18-17(11-14)19(25-24-18)23-20(27)13-5-2-1-3-6-13/h1-12,26H,(H,22,28)(H2,23,24,25,27)
InChIKeyPRUFGXHTQBGXCP-UHFFFAOYSA-N
XLogP3.77
TPSA107.11 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 53.77
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-hydroxy-1H-indazol-3-yl)benzamide
CID 45086916
3-benzamido-1H-indazole-5-carboxylic acid
CID 129093990
N-[5-(piperidine-1-carbonyl)-1H-indazol-3-yl]benzamide
CID 129094014
N-(3-chlorophenyl)-3-phenyl-1H-indazole-5-carboxamide
CID 162666626
4-benzoyl-N-(5-nitro-1H-indazol-3-yl)benzamide
CID 71907763
5-amino-N-(3-hydroxyphenyl)-1H-indazole-3-carboxamide
CID 61165913
4-[(3-phenyl-1H-indazol-5-yl)carbamoyl]benzoic acid
CID 22479735
N-[5-(5-amino-3-pyridinyl)-1H-indazol-3-yl]benzamide
CID 171349998
3-[(3-hydroxybenzoyl)amino]benzamide
CID 103605136
4-chloro-N-(1H-indazol-3-yl)benzamide
CID 12913046
4-(dimethylamino)-N-(3-hydroxyphenyl)benzamide
CID 28739881
N-[5-[(3,4-dichlorophenyl)sulfamoyl]-1H-indazol-3-yl]benzamide
CID 22567162

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide?
The IUPAC name of 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide (CID 142752240) is 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide.
What is the SMILES notation for 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide?
The canonical SMILES for 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide is O=C(Nc1cccc(O)c1)c1ccc2[nH]nc(NC(=O)c3ccccc3)c2c1.
What is the InChIKey of 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide?
The InChIKey is PRUFGXHTQBGXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O3/c26-16-8-4-7-15(12-16)22-21(28)14-9-10-18-17(11-14)19(25-24-18)23-20(27)13-5-2-1-3-6-13/h1-12,26H,(H,22,28)(H2,23,24,25,27).
What are the key properties of 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide?
3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide has a molecular weight of 372.38 g/mol, XLogP of 3.77, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-(3-hydroxyphenyl)-1H-indazole-5-carboxamide is sourced from PubChem (CID 142752240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).