N-(4-fluorophenyl)pyrazine-2-carboxamide

C11H8FN3O — CID 746701

IUPACN-(4-fluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cnccn1
InChIInChI=1S/C11H8FN3O/c12-8-1-3-9(4-2-8)15-11(16)10-7-13-5-6-14-10/h1-7H,(H,15,16)
InChIKeyGYYWBZYUXVRWBM-UHFFFAOYSA-N
MW217.20 g/mol
LogP1.87
Rot. Bonds2

About N-(4-fluorophenyl)pyrazine-2-carboxamide

N-(4-fluorophenyl)pyrazine-2-carboxamide (PubChem CID 746701) has the molecular formula C11H8FN3O and a molecular weight of 217.20 g/mol. Its IUPAC name is N-(4-fluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)pyrazine-2-carboxamide
PubChem CID746701
Molecular FormulaC11H8FN3O
Molecular Weight217.20 g/mol
Exact Mass217.07
IUPAC NameN-(4-fluorophenyl)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cnccn1
InChIInChI=1S/C11H8FN3O/c12-8-1-3-9(4-2-8)15-11(16)10-7-13-5-6-14-10/h1-7H,(H,15,16)
InChIKeyGYYWBZYUXVRWBM-UHFFFAOYSA-N
XLogP1.87
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.20
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of N-(4-fluorophenyl)pyrazine-2-carboxamide (CID 746701) is N-(4-fluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)pyrazine-2-carboxamide is O=C(Nc1ccc(F)cc1)c1cnccn1.
What is the InChIKey of N-(4-fluorophenyl)pyrazine-2-carboxamide?
The InChIKey is GYYWBZYUXVRWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3O/c12-8-1-3-9(4-2-8)15-11(16)10-7-13-5-6-14-10/h1-7H,(H,15,16).
What are the key properties of N-(4-fluorophenyl)pyrazine-2-carboxamide?
N-(4-fluorophenyl)pyrazine-2-carboxamide has a molecular weight of 217.20 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 746701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).