N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide

C12H8FN5O — CID 51102709

IUPACN-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1n[nH]c2cccc(F)c12)c1cnccn1
InChIInChI=1S/C12H8FN5O/c13-7-2-1-3-8-10(7)11(18-17-8)16-12(19)9-6-14-4-5-15-9/h1-6H,(H2,16,17,18,19)
InChIKeyFKMZWRVIFYGWOX-UHFFFAOYSA-N
MW257.23 g/mol
LogP1.74
Rot. Bonds2

About N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide

N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide (PubChem CID 51102709) has the molecular formula C12H8FN5O and a molecular weight of 257.23 g/mol. Its IUPAC name is N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide
PubChem CID51102709
Molecular FormulaC12H8FN5O
Molecular Weight257.23 g/mol
Exact Mass257.07
IUPAC NameN-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide
SMILESO=C(Nc1n[nH]c2cccc(F)c12)c1cnccn1
InChIInChI=1S/C12H8FN5O/c13-7-2-1-3-8-10(7)11(18-17-8)16-12(19)9-6-14-4-5-15-9/h1-6H,(H2,16,17,18,19)
InChIKeyFKMZWRVIFYGWOX-UHFFFAOYSA-N
XLogP1.74
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.23
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide?
The IUPAC name of N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide (CID 51102709) is N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide is O=C(Nc1n[nH]c2cccc(F)c12)c1cnccn1.
What is the InChIKey of N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide?
The InChIKey is FKMZWRVIFYGWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN5O/c13-7-2-1-3-8-10(7)11(18-17-8)16-12(19)9-6-14-4-5-15-9/h1-6H,(H2,16,17,18,19).
What are the key properties of N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide?
N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide has a molecular weight of 257.23 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-1H-indazol-3-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 51102709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).