N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide

C14H9BrFN3O — CID 62919566

IUPACN-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc2cn[nH]c2c1
InChIInChI=1S/C14H9BrFN3O/c15-11-6-10(16)3-4-12(11)18-14(20)8-1-2-9-7-17-19-13(9)5-8/h1-7H,(H,17,19)(H,18,20)
InChIKeyXUVCUQBBGWCWEE-UHFFFAOYSA-N
MW334.15 g/mol
LogP3.72
Rot. Bonds2

About N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide

N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide (PubChem CID 62919566) has the molecular formula C14H9BrFN3O and a molecular weight of 334.15 g/mol. Its IUPAC name is N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide
PubChem CID62919566
Molecular FormulaC14H9BrFN3O
Molecular Weight334.15 g/mol
Exact Mass332.99
IUPAC NameN-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc2cn[nH]c2c1
InChIInChI=1S/C14H9BrFN3O/c15-11-6-10(16)3-4-12(11)18-14(20)8-1-2-9-7-17-19-13(9)5-8/h1-7H,(H,17,19)(H,18,20)
InChIKeyXUVCUQBBGWCWEE-UHFFFAOYSA-N
XLogP3.72
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.15
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-2-fluorophenyl)-1H-indazole-6-carboxamide
CID 60716242
N-(2-bromo-4-fluorophenyl)-4-fluorobenzamide
CID 28938573
N-(5-bromo-2-methylphenyl)-1H-indazole-6-carboxamide
CID 62921443
N-(5-bromo-2-chlorophenyl)-1H-indazole-6-carboxamide
CID 62909267
N-(2,4-dichlorophenyl)-1H-indazole-6-carboxamide
CID 60715317
4-bromo-N-(2-bromo-4-fluorophenyl)-3-fluorobenzamide
CID 47421840
N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide
CID 60715106
N-(2-acetylphenyl)-1H-indazole-6-carboxamide
CID 110485418
N-[(2,5-difluorophenyl)methyl]-1H-indazole-6-carboxamide
CID 63379684
2-bromo-4-fluoro-N-(1H-indazol-4-yl)benzamide
CID 60933063
N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide
CID 28938574
4-amino-N-(2-bromo-4-fluorophenyl)-3-methylbenzamide
CID 28938520

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide (CID 62919566) is N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide is O=C(Nc1ccc(F)cc1Br)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide?
The InChIKey is XUVCUQBBGWCWEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrFN3O/c15-11-6-10(16)3-4-12(11)18-14(20)8-1-2-9-7-17-19-13(9)5-8/h1-7H,(H,17,19)(H,18,20).
What are the key properties of N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide?
N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide has a molecular weight of 334.15 g/mol, XLogP of 3.72, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 62919566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).