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

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Related Compounds

8-Oxa-14,21,23,28-tetraazapentacyclo[23.3.1.02,7.014,22.015,20]nonacosa-1(28),2(7),3,5,15,17,19,21,25(29),26-decaen-24-one
CID 139593670
{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofuran-5-yl}-(5-trifluoromethyl-pyridin-2-yl)-amine
CID 11574624
{2-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-benzofuran-5-yl}-pyrazin-2-yl-amine
CID 11695489
3-methyl-N-(5-methyl-2-pyridinyl)-2-benzofurancarboxamide
CID 18106749
3-methyl-N-(4-methylpyridin-2-yl)-1-benzofuran-2-carboxamide
CID 21211963
4-Fluoro-N-[6-(2-furyl)-5-pyridin-4-ylpyrazin-2-yl]benzamide
CID 16070216
(E)-N-methyl-N-[(3-methyl-1-benzofuran-2-yl)methyl]-3-(4-oxo-1,2,3,5-tetrahydropyrido[2,3-b][1,4]diazepin-8-yl)prop-2-enamide
CID 23657990
(E)-N-methyl-N-((3-methylbenzofuran-2-yl)methyl)-3-(2,3,4,5-tetrahydro-1H-pyrido[2,3-b][1,4]diazepin-8-yl)acrylamide
CID 24891660
N-[3-(3-acetylphenyl)-6-[2-methoxy-phenyl)imidazo [1,2-a]pyridin-8-yl]acetamide
CID 49789743
4-[5-(1-benzofuran-2-carbonylamino)-2-pyridinyl]-N-(2-fluorophenyl)piperazine-1-carboxamide
CID 52917419
4-[5-[[3-(fluoromethyl)-1-benzofuran-2-carbonyl]amino]-2-pyridinyl]-N-(2-fluorophenyl)piperazine-1-carboxamide
CID 52917492
N-(2-fluorophenyl)-4-[5-[(3-methyl-1-benzofuran-2-carbonyl)amino]-2-pyridinyl]piperazine-1-carboxamide
CID 52917631

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).