4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide

C22H15FN4O2 — CID 10309474

IUPAC4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide
SMILESO=C(Nc1cc(Oc2cccnc2)cc(-c2cnccn2)c1)c1ccc(F)cc1
InChIInChI=1S/C22H15FN4O2/c23-17-5-3-15(4-6-17)22(28)27-18-10-16(21-14-25-8-9-26-21)11-20(12-18)29-19-2-1-7-24-13-19/h1-14H,(H,27,28)
InChIKeyAEMOBTAPCIDTGO-UHFFFAOYSA-N
MW386.39 g/mol
LogP4.72
Rot. Bonds5

About 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide

4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide (PubChem CID 10309474) has the molecular formula C22H15FN4O2 and a molecular weight of 386.39 g/mol. Its IUPAC name is 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide
PubChem CID10309474
Molecular FormulaC22H15FN4O2
Molecular Weight386.39 g/mol
Exact Mass386.12
IUPAC Name4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide
SMILESO=C(Nc1cc(Oc2cccnc2)cc(-c2cnccn2)c1)c1ccc(F)cc1
InChIInChI=1S/C22H15FN4O2/c23-17-5-3-15(4-6-17)22(28)27-18-10-16(21-14-25-8-9-26-21)11-20(12-18)29-19-2-1-7-24-13-19/h1-14H,(H,27,28)
InChIKeyAEMOBTAPCIDTGO-UHFFFAOYSA-N
XLogP4.72
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.39
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
The IUPAC name of 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide (CID 10309474) is 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
The canonical SMILES for 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide is O=C(Nc1cc(Oc2cccnc2)cc(-c2cnccn2)c1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
The InChIKey is AEMOBTAPCIDTGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN4O2/c23-17-5-3-15(4-6-17)22(28)27-18-10-16(21-14-25-8-9-26-21)11-20(12-18)29-19-2-1-7-24-13-19/h1-14H,(H,27,28).
What are the key properties of 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide has a molecular weight of 386.39 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(3-pyrazin-2-yl-5-pyridin-3-yloxyphenyl)benzamide is sourced from PubChem (CID 10309474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).