N-quinoxalin-6-ylpyrazine-2-carboxamide

C13H9N5O — CID 646169

IUPACN-quinoxalin-6-ylpyrazine-2-carboxamide
SMILESO=C(Nc1ccc2nccnc2c1)c1cnccn1
InChIInChI=1S/C13H9N5O/c19-13(12-8-14-3-4-17-12)18-9-1-2-10-11(7-9)16-6-5-15-10/h1-8H,(H,18,19)
InChIKeyWAKQPEMLGVEZGD-UHFFFAOYSA-N
MW251.25 g/mol
LogP1.67
Rot. Bonds2

About N-quinoxalin-6-ylpyrazine-2-carboxamide

N-quinoxalin-6-ylpyrazine-2-carboxamide (PubChem CID 646169) has the molecular formula C13H9N5O and a molecular weight of 251.25 g/mol. Its IUPAC name is N-quinoxalin-6-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-quinoxalin-6-ylpyrazine-2-carboxamide
PubChem CID646169
Molecular FormulaC13H9N5O
Molecular Weight251.25 g/mol
Exact Mass251.08
IUPAC NameN-quinoxalin-6-ylpyrazine-2-carboxamide
SMILESO=C(Nc1ccc2nccnc2c1)c1cnccn1
InChIInChI=1S/C13H9N5O/c19-13(12-8-14-3-4-17-12)18-9-1-2-10-11(7-9)16-6-5-15-10/h1-8H,(H,18,19)
InChIKeyWAKQPEMLGVEZGD-UHFFFAOYSA-N
XLogP1.67
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.25
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-quinoxalin-6-ylpyrazine-2-carboxamide?
The IUPAC name of N-quinoxalin-6-ylpyrazine-2-carboxamide (CID 646169) is N-quinoxalin-6-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-quinoxalin-6-ylpyrazine-2-carboxamide?
The canonical SMILES for N-quinoxalin-6-ylpyrazine-2-carboxamide is O=C(Nc1ccc2nccnc2c1)c1cnccn1.
What is the InChIKey of N-quinoxalin-6-ylpyrazine-2-carboxamide?
The InChIKey is WAKQPEMLGVEZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N5O/c19-13(12-8-14-3-4-17-12)18-9-1-2-10-11(7-9)16-6-5-15-10/h1-8H,(H,18,19).
What are the key properties of N-quinoxalin-6-ylpyrazine-2-carboxamide?
N-quinoxalin-6-ylpyrazine-2-carboxamide has a molecular weight of 251.25 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinoxalin-6-ylpyrazine-2-carboxamide is sourced from PubChem (CID 646169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).