N-(2-bromophenyl)quinoxaline-2-carboxamide

C15H10BrN3O — CID 17429565

IUPACN-(2-bromophenyl)quinoxaline-2-carboxamide
SMILESO=C(Nc1ccccc1Br)c1cnc2ccccc2n1
InChIInChI=1S/C15H10BrN3O/c16-10-5-1-2-6-11(10)19-15(20)14-9-17-12-7-3-4-8-13(12)18-14/h1-9H,(H,19,20)
InChIKeyQUNWICGVMVBUBY-UHFFFAOYSA-N
MW328.17 g/mol
LogP3.64
Rot. Bonds2

About N-(2-bromophenyl)quinoxaline-2-carboxamide

N-(2-bromophenyl)quinoxaline-2-carboxamide (PubChem CID 17429565) has the molecular formula C15H10BrN3O and a molecular weight of 328.17 g/mol. Its IUPAC name is N-(2-bromophenyl)quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)quinoxaline-2-carboxamide
PubChem CID17429565
Molecular FormulaC15H10BrN3O
Molecular Weight328.17 g/mol
Exact Mass327.00
IUPAC NameN-(2-bromophenyl)quinoxaline-2-carboxamide
SMILESO=C(Nc1ccccc1Br)c1cnc2ccccc2n1
InChIInChI=1S/C15H10BrN3O/c16-10-5-1-2-6-11(10)19-15(20)14-9-17-12-7-3-4-8-13(12)18-14/h1-9H,(H,19,20)
InChIKeyQUNWICGVMVBUBY-UHFFFAOYSA-N
XLogP3.64
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.17
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-bromoanilino)-2-oxoethyl]quinoxaline-2-carboxamide
CID 9456802
4-amino-N-(2-bromophenyl)quinoline-2-carboxamide
CID 63375071
N-(4-chloro-2-iodophenyl)quinoxaline-2-carboxamide
CID 75380970
N-(2-bromophenyl)-2-quinoxalin-2-yloxyacetamide
CID 2096177
N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide
CID 95763379
N-(2-methyl-5-methylsulfonylphenyl)quinoxaline-2-carboxamide
CID 27990943
N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide
CID 131923245
N-(2-methyl-3-nitrophenyl)quinoxaline-2-carboxamide
CID 17420585
N-[2-(piperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide
CID 17420584
N-(6-chloropyrazin-2-yl)quinoxaline-2-carboxamide
CID 104938179
N-(4-chloro-2,5-dimethoxyphenyl)quinoxaline-2-carboxamide
CID 17433781
N-(2-bromophenyl)-5-(tert-butylamino)pyrazine-2-carboxamide
CID 109287425

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)quinoxaline-2-carboxamide?
The IUPAC name of N-(2-bromophenyl)quinoxaline-2-carboxamide (CID 17429565) is N-(2-bromophenyl)quinoxaline-2-carboxamide.
What is the SMILES notation for N-(2-bromophenyl)quinoxaline-2-carboxamide?
The canonical SMILES for N-(2-bromophenyl)quinoxaline-2-carboxamide is O=C(Nc1ccccc1Br)c1cnc2ccccc2n1.
What is the InChIKey of N-(2-bromophenyl)quinoxaline-2-carboxamide?
The InChIKey is QUNWICGVMVBUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrN3O/c16-10-5-1-2-6-11(10)19-15(20)14-9-17-12-7-3-4-8-13(12)18-14/h1-9H,(H,19,20).
What are the key properties of N-(2-bromophenyl)quinoxaline-2-carboxamide?
N-(2-bromophenyl)quinoxaline-2-carboxamide has a molecular weight of 328.17 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)quinoxaline-2-carboxamide is sourced from PubChem (CID 17429565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).