2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide

C20H13F2N3O2 — CID 58487380

IUPAC2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide
SMILESCc1oc2ccccc2c1-c1cnc(NC(=O)c2c(F)cccc2F)cn1
InChIInChI=1S/C20H13F2N3O2/c1-11-18(12-5-2-3-8-16(12)27-11)15-9-24-17(10-23-15)25-20(26)19-13(21)6-4-7-14(19)22/h2-10H,1H3,(H,24,25,26)
InChIKeyHNJZEXOFCGFEPZ-UHFFFAOYSA-N
MW365.34 g/mol
LogP4.73
Rot. Bonds3

About 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide

2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide (PubChem CID 58487380) has the molecular formula C20H13F2N3O2 and a molecular weight of 365.34 g/mol. Its IUPAC name is 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide
PubChem CID58487380
Molecular FormulaC20H13F2N3O2
Molecular Weight365.34 g/mol
Exact Mass365.10
IUPAC Name2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide
SMILESCc1oc2ccccc2c1-c1cnc(NC(=O)c2c(F)cccc2F)cn1
InChIInChI=1S/C20H13F2N3O2/c1-11-18(12-5-2-3-8-16(12)27-11)15-9-24-17(10-23-15)25-20(26)19-13(21)6-4-7-14(19)22/h2-10H,1H3,(H,24,25,26)
InChIKeyHNJZEXOFCGFEPZ-UHFFFAOYSA-N
XLogP4.73
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.34
LogP ≤ 54.73
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 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
The IUPAC name of 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide (CID 58487380) is 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide is Cc1oc2ccccc2c1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.
What is the InChIKey of 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
The InChIKey is HNJZEXOFCGFEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F2N3O2/c1-11-18(12-5-2-3-8-16(12)27-11)15-9-24-17(10-23-15)25-20(26)19-13(21)6-4-7-14(19)22/h2-10H,1H3,(H,24,25,26).
What are the key properties of 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide?
2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide has a molecular weight of 365.34 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[5-(2-methyl-1-benzofuran-3-yl)pyrazin-2-yl]benzamide is sourced from PubChem (CID 58487380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).