N-(3-chlorophenyl)quinoxaline-2-carboxamide

C15H10ClN3O — CID 7678294

IUPACN-(3-chlorophenyl)quinoxaline-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cnc2ccccc2n1
InChIInChI=1S/C15H10ClN3O/c16-10-4-3-5-11(8-10)18-15(20)14-9-17-12-6-1-2-7-13(12)19-14/h1-9H,(H,18,20)
InChIKeyMJPHPKRCPGVEBI-UHFFFAOYSA-N
MW283.72 g/mol
LogP3.54
Rot. Bonds2

About N-(3-chlorophenyl)quinoxaline-2-carboxamide

N-(3-chlorophenyl)quinoxaline-2-carboxamide (PubChem CID 7678294) has the molecular formula C15H10ClN3O and a molecular weight of 283.72 g/mol. Its IUPAC name is N-(3-chlorophenyl)quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)quinoxaline-2-carboxamide
PubChem CID7678294
Molecular FormulaC15H10ClN3O
Molecular Weight283.72 g/mol
Exact Mass283.05
IUPAC NameN-(3-chlorophenyl)quinoxaline-2-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cnc2ccccc2n1
InChIInChI=1S/C15H10ClN3O/c16-10-4-3-5-11(8-10)18-15(20)14-9-17-12-6-1-2-7-13(12)19-14/h1-9H,(H,18,20)
InChIKeyMJPHPKRCPGVEBI-UHFFFAOYSA-N
XLogP3.54
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.72
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)quinoxaline-2-carboxamide?
The IUPAC name of N-(3-chlorophenyl)quinoxaline-2-carboxamide (CID 7678294) is N-(3-chlorophenyl)quinoxaline-2-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)quinoxaline-2-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)quinoxaline-2-carboxamide is O=C(Nc1cccc(Cl)c1)c1cnc2ccccc2n1.
What is the InChIKey of N-(3-chlorophenyl)quinoxaline-2-carboxamide?
The InChIKey is MJPHPKRCPGVEBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O/c16-10-4-3-5-11(8-10)18-15(20)14-9-17-12-6-1-2-7-13(12)19-14/h1-9H,(H,18,20).
What are the key properties of N-(3-chlorophenyl)quinoxaline-2-carboxamide?
N-(3-chlorophenyl)quinoxaline-2-carboxamide has a molecular weight of 283.72 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)quinoxaline-2-carboxamide is sourced from PubChem (CID 7678294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).