N-(2-bromophenyl)-4-methylindazole-1-carboxamide

C15H12BrN3O — CID 22510437

IUPACN-(2-bromophenyl)-4-methylindazole-1-carboxamide
SMILESCc1cccc2c1cnn2C(=O)Nc1ccccc1Br
InChIInChI=1S/C15H12BrN3O/c1-10-5-4-8-14-11(10)9-17-19(14)15(20)18-13-7-3-2-6-12(13)16/h2-9H,1H3,(H,18,20)
InChIKeyJWZLZMYILQLFET-UHFFFAOYSA-N
MW330.19 g/mol
LogP4.19
Rot. Bonds1

About N-(2-bromophenyl)-4-methylindazole-1-carboxamide

N-(2-bromophenyl)-4-methylindazole-1-carboxamide (PubChem CID 22510437) has the molecular formula C15H12BrN3O and a molecular weight of 330.19 g/mol. Its IUPAC name is N-(2-bromophenyl)-4-methylindazole-1-carboxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-4-methylindazole-1-carboxamide
PubChem CID22510437
Molecular FormulaC15H12BrN3O
Molecular Weight330.19 g/mol
Exact Mass329.02
IUPAC NameN-(2-bromophenyl)-4-methylindazole-1-carboxamide
SMILESCc1cccc2c1cnn2C(=O)Nc1ccccc1Br
InChIInChI=1S/C15H12BrN3O/c1-10-5-4-8-14-11(10)9-17-19(14)15(20)18-13-7-3-2-6-12(13)16/h2-9H,1H3,(H,18,20)
InChIKeyJWZLZMYILQLFET-UHFFFAOYSA-N
XLogP4.19
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.19
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethylphenyl)-4-methyl-1H-indazole-1-carboxamide
CID 16016793
N-(4-bromo-2-fluorophenyl)-4-methyl-1H-indazole-1-carboxamide
CID 22510442
N-(2,5-difluorophenyl)-4-methyl-1H-indazole-1-carboxamide
CID 22510443
N-(2-chlorophenyl)-4-methyl-1H-indazole-1-carboxamide
CID 22510451
1-[(4-bromophenyl)methyl]-3-1H-indazol-5-ylurea
CID 24768216
1-[(4-bromophenyl)methyl]-3-(1-methyl-1H-indazol-4-yl)urea
CID 24768217
N-[4-(1-methyl-1H-indazol-4-yl)-phenyl]-N''-(3-methylphenyl)urea
CID 16125514
N-(3-fluoro-4-methylphenyl)-4-methyl-1H-indazole-1-carboxamide
CID 22510428
N-(4-phenylbutyl)indazole-1-carboxamide
CID 137649927
N-hexylindazole-1-carboxamide
CID 137653597
1-[(4-bromophenyl)methyl]-3-(2-methyl-2H-indazol-4-yl)urea
CID 24768218
N-(4-bromo-3-methylphenyl)-4-methyl-1H-indazole-1-carboxamide
CID 16016797

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-4-methylindazole-1-carboxamide?
The IUPAC name of N-(2-bromophenyl)-4-methylindazole-1-carboxamide (CID 22510437) is N-(2-bromophenyl)-4-methylindazole-1-carboxamide.
What is the SMILES notation for N-(2-bromophenyl)-4-methylindazole-1-carboxamide?
The canonical SMILES for N-(2-bromophenyl)-4-methylindazole-1-carboxamide is Cc1cccc2c1cnn2C(=O)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-4-methylindazole-1-carboxamide?
The InChIKey is JWZLZMYILQLFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O/c1-10-5-4-8-14-11(10)9-17-19(14)15(20)18-13-7-3-2-6-12(13)16/h2-9H,1H3,(H,18,20).
What are the key properties of N-(2-bromophenyl)-4-methylindazole-1-carboxamide?
N-(2-bromophenyl)-4-methylindazole-1-carboxamide has a molecular weight of 330.19 g/mol, XLogP of 4.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-4-methylindazole-1-carboxamide is sourced from PubChem (CID 22510437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).