5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide

C15H10BrN5O — CID 117073881

IUPAC5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)c1n[nH]c2ccc(Br)cc12
InChIInChI=1S/C15H10BrN5O/c16-9-2-4-12-11(5-9)14(21-20-12)15(22)18-10-3-1-8-7-17-19-13(8)6-10/h1-7H,(H,17,19)(H,18,22)(H,20,21)
InChIKeyUZPQYUVQVIEYSL-UHFFFAOYSA-N
MW356.18 g/mol
LogP3.45
Rot. Bonds2

About 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide

5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide (PubChem CID 117073881) has the molecular formula C15H10BrN5O and a molecular weight of 356.18 g/mol. Its IUPAC name is 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide
PubChem CID117073881
Molecular FormulaC15H10BrN5O
Molecular Weight356.18 g/mol
Exact Mass355.01
IUPAC Name5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)c1n[nH]c2ccc(Br)cc12
InChIInChI=1S/C15H10BrN5O/c16-9-2-4-12-11(5-9)14(21-20-12)15(22)18-10-3-1-8-7-17-19-13(8)6-10/h1-7H,(H,17,19)(H,18,22)(H,20,21)
InChIKeyUZPQYUVQVIEYSL-UHFFFAOYSA-N
XLogP3.45
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.18
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(1H-indazol-6-yl)-2-methylbenzamide
CID 65311641
1-(4-bromophenyl)-3-(1H-indazol-6-yl)urea
CID 108869291
6-bromo-N-(1H-indazol-6-yl)pyridine-3-carboxamide
CID 66464887
N-(1H-indazol-6-yl)-4-methyl-1,2,5-oxadiazole-3-carboxamide
CID 110692000
4-bromo-N-(1H-indazol-6-yl)-3-methylbenzamide
CID 115769574
5-bromo-N-(1H-indazol-5-yl)-2-methylbenzamide
CID 65311684
N-(1H-indazol-6-yl)-3,5-dimethylbenzamide
CID 36560760
N'-(2-bromophenyl)-N-(1H-indazol-6-yl)oxamide
CID 108530119
5-bromo-N-(1H-indazol-6-yl)-4-methylthiophene-2-carboxamide
CID 79964870
5-amino-N-(4-bromo-3-methylphenyl)-1H-indazole-3-carboxamide
CID 60904873
5-bromo-1H-indazole-3-carboxylate
CID 7157357
N-(1H-indazol-6-yl)-2H-benzotriazole-5-carboxamide
CID 36561248

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide (CID 117073881) is 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide is O=C(Nc1ccc2cn[nH]c2c1)c1n[nH]c2ccc(Br)cc12.
What is the InChIKey of 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide?
The InChIKey is UZPQYUVQVIEYSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrN5O/c16-9-2-4-12-11(5-9)14(21-20-12)15(22)18-10-3-1-8-7-17-19-13(8)6-10/h1-7H,(H,17,19)(H,18,22)(H,20,21).
What are the key properties of 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide?
5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide has a molecular weight of 356.18 g/mol, XLogP of 3.45, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1H-indazol-6-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 117073881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).