2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide

C20H14FN3O2 — CID 58486749

IUPAC2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide
SMILESCc1oc2ccccc2c1-c1cnc(NC(=O)c2ccccc2F)cn1
InChIInChI=1S/C20H14FN3O2/c1-12-19(14-7-3-5-9-17(14)26-12)16-10-23-18(11-22-16)24-20(25)13-6-2-4-8-15(13)21/h2-11H,1H3,(H,23,24,25)
InChIKeyNWUDYORUHUMAJT-UHFFFAOYSA-N
MW347.35 g/mol
LogP4.59
Rot. Bonds3

About 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide

2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide (PubChem CID 58486749) has the molecular formula C20H14FN3O2 and a molecular weight of 347.35 g/mol. Its IUPAC name is 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide
PubChem CID58486749
Molecular FormulaC20H14FN3O2
Molecular Weight347.35 g/mol
Exact Mass347.11
IUPAC Name2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide
SMILESCc1oc2ccccc2c1-c1cnc(NC(=O)c2ccccc2F)cn1
InChIInChI=1S/C20H14FN3O2/c1-12-19(14-7-3-5-9-17(14)26-12)16-10-23-18(11-22-16)24-20(25)13-6-2-4-8-15(13)21/h2-11H,1H3,(H,23,24,25)
InChIKeyNWUDYORUHUMAJT-UHFFFAOYSA-N
XLogP4.59
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.35
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
The IUPAC name of 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide (CID 58486749) is 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide.
What is the SMILES notation for 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
The canonical SMILES for 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide is Cc1oc2ccccc2c1-c1cnc(NC(=O)c2ccccc2F)cn1.
What is the InChIKey of 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
The InChIKey is NWUDYORUHUMAJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O2/c1-12-19(14-7-3-5-9-17(14)26-12)16-10-23-18(11-22-16)24-20(25)13-6-2-4-8-15(13)21/h2-11H,1H3,(H,23,24,25).
What are the key properties of 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide has a molecular weight of 347.35 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide is sourced from PubChem (CID 58486749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).