N-(2,4-difluorophenyl)pyrazine-2-carboxamide

C11H7F2N3O — CID 739901

IUPACN-(2,4-difluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cnccn1
InChIInChI=1S/C11H7F2N3O/c12-7-1-2-9(8(13)5-7)16-11(17)10-6-14-3-4-15-10/h1-6H,(H,16,17)
InChIKeyRIUFHAGLQYVUKI-UHFFFAOYSA-N
MW235.19 g/mol
LogP2.01
Rot. Bonds2

About N-(2,4-difluorophenyl)pyrazine-2-carboxamide

N-(2,4-difluorophenyl)pyrazine-2-carboxamide (PubChem CID 739901) has the molecular formula C11H7F2N3O and a molecular weight of 235.19 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)pyrazine-2-carboxamide
PubChem CID739901
Molecular FormulaC11H7F2N3O
Molecular Weight235.19 g/mol
Exact Mass235.06
IUPAC NameN-(2,4-difluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cnccn1
InChIInChI=1S/C11H7F2N3O/c12-7-1-2-9(8(13)5-7)16-11(17)10-6-14-3-4-15-10/h1-6H,(H,16,17)
InChIKeyRIUFHAGLQYVUKI-UHFFFAOYSA-N
XLogP2.01
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.19
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Quinoxaline-2-carboxamide
CID 78857
N-(2-fluorophenyl)-2-pyrazinecarboxamide
CID 803568
BG-45
CID 16773791
N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 803312
N-(4-methylphenyl)pyrazine-2-carboxamide
CID 746705
N-(4-morpholin-4-ylphenyl)pyrazine-2-carboxamide
CID 7409168
N-(4-methylbenzyl)-2-pyrazinecarboxamide
CID 897112
N-pyridin-3-ylquinoxaline-2-carboxamide
CID 3237194
N-cyclopentylquinoxaline-2-carboxamide
CID 3432949
N-(3-chlorophenyl)pyrazine-2-carboxamide
CID 470912
N-(3-methylphenyl)pyrazine-2-carboxamide
CID 743190
N-benzylpyrazine-2-carboxamide
CID 470909

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)pyrazine-2-carboxamide (CID 739901) is N-(2,4-difluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)pyrazine-2-carboxamide is O=C(Nc1ccc(F)cc1F)c1cnccn1.
What is the InChIKey of N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
The InChIKey is RIUFHAGLQYVUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F2N3O/c12-7-1-2-9(8(13)5-7)16-11(17)10-6-14-3-4-15-10/h1-6H,(H,16,17).
What are the key properties of N-(2,4-difluorophenyl)pyrazine-2-carboxamide?
N-(2,4-difluorophenyl)pyrazine-2-carboxamide has a molecular weight of 235.19 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 739901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).