2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide

C135H121Cl2F6N15O12 — CID 159849245

IUPAC2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide
SMILESCc1cc2c(cc1-c1ccc(NC(=O)c3c(F)cccc3F)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3Cl)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3F)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3c(F)cccc3F)cn1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3Cl)cn1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3F)cn1)CC(C)(C)O2
InChIInChI=1S/C23H21ClN2O2.C23H20F2N2O2.C23H21FN2O2.C22H20ClN3O2.C22H19F2N3O2.C22H20FN3O2/c1-14-10-20-16(12-23(2,3)28-20)11-18(14)15-8-9-21(25-13-15)26-22(27)17-6-4-5-7-19(17)24;1-13-9-19-15(11-23(2,3)29-19)10-16(13)14-7-8-20(26-12-14)27-22(28)21-17(24)5-4-6-18(21)25;1-14-10-20-16(12-23(2,3)28-20)11-18(14)15-8-9-21(25-13-15)26-22(27)17-6-4-5-7-19(17)24;1-13-8-19-14(10-22(2,3)28-19)9-16(13)18-11-25-20(12-24-18)26-21(27)15-6-4-5-7-17(15)23;1-12-7-18-13(9-22(2,3)29-18)8-14(12)17-10-26-19(11-25-17)27-21(28)20-15(23)5-4-6-16(20)24;1-13-8-19-14(10-22(2,3)28-19)9-16(13)18-11-25-20(12-24-18)26-21(27)15-6-4-5-7-17(15)23/h4-11,13H,12H2,1-3H3,(H,25,26,27);4-10,12H,11H2,1-3H3,(H,26,27,28);4-11,13H,12H2,1-3H3,(H,25,26,27);4-9,11-12H,10H2,1-3H3,(H,25,26,27);4-8,10-11H,9H2,1-3H3,(H,26,27,28);4-9,11-12H,10H2,1-3H3,(H,25,26,27)
InChIKeyNPSFJZONECDRCI-UHFFFAOYSA-N
MW2330.44 g/mol
LogP30.46
Rot. Bonds18

About 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide

2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide (PubChem CID 159849245) has the molecular formula C135H121Cl2F6N15O12 and a molecular weight of 2330.44 g/mol. Its IUPAC name is 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide
PubChem CID159849245
Molecular FormulaC135H121Cl2F6N15O12
Molecular Weight2330.44 g/mol
Exact Mass2327.86
IUPAC Name2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide
SMILESCc1cc2c(cc1-c1ccc(NC(=O)c3c(F)cccc3F)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3Cl)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3F)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3c(F)cccc3F)cn1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3Cl)cn1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3F)cn1)CC(C)(C)O2
InChIInChI=1S/C23H21ClN2O2.C23H20F2N2O2.C23H21FN2O2.C22H20ClN3O2.C22H19F2N3O2.C22H20FN3O2/c1-14-10-20-16(12-23(2,3)28-20)11-18(14)15-8-9-21(25-13-15)26-22(27)17-6-4-5-7-19(17)24;1-13-9-19-15(11-23(2,3)29-19)10-16(13)14-7-8-20(26-12-14)27-22(28)21-17(24)5-4-6-18(21)25;1-14-10-20-16(12-23(2,3)28-20)11-18(14)15-8-9-21(25-13-15)26-22(27)17-6-4-5-7-19(17)24;1-13-8-19-14(10-22(2,3)28-19)9-16(13)18-11-25-20(12-24-18)26-21(27)15-6-4-5-7-17(15)23;1-12-7-18-13(9-22(2,3)29-18)8-14(12)17-10-26-19(11-25-17)27-21(28)20-15(23)5-4-6-16(20)24;1-13-8-19-14(10-22(2,3)28-19)9-16(13)18-11-25-20(12-24-18)26-21(27)15-6-4-5-7-17(15)23/h4-11,13H,12H2,1-3H3,(H,25,26,27);4-10,12H,11H2,1-3H3,(H,26,27,28);4-11,13H,12H2,1-3H3,(H,25,26,27);4-9,11-12H,10H2,1-3H3,(H,25,26,27);4-8,10-11H,9H2,1-3H3,(H,26,27,28);4-9,11-12H,10H2,1-3H3,(H,25,26,27)
InChIKeyNPSFJZONECDRCI-UHFFFAOYSA-N
XLogP30.46
TPSA345.99 Ų
H-Bond Donors6
H-Bond Acceptors21
Rotatable Bonds18
Heavy Atoms170
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002330.44
LogP ≤ 530.46
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1021

Analyze 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide?
The IUPAC name of 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide (CID 159849245) is 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide.
What is the SMILES notation for 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide?
The canonical SMILES for 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide is Cc1cc2c(cc1-c1ccc(NC(=O)c3c(F)cccc3F)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3Cl)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3F)nc1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3c(F)cccc3F)cn1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3Cl)cn1)CC(C)(C)O2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3F)cn1)CC(C)(C)O2.
What is the InChIKey of 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide?
The InChIKey is NPSFJZONECDRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN2O2.C23H20F2N2O2.C23H21FN2O2.C22H20ClN3O2.C22H19F2N3O2.C22H20FN3O2/c1-14-10-20-16(12-23(2,3)28-20)11-18(14)15-8-9-21(25-13-15)26-22(27)17-6-4-5-7-19(17)24;1-13-9-19-15(11-23(2,3)29-19)10-16(13)14-7-8-20(26-12-14)27-22(28)21-17(24)5-4-6-18(21)25;1-14-10-20-16(12-23(2,3)28-20)11-18(14)15-8-9-21(25-13-15)26-22(27)17-6-4-5-7-19(17)24;1-13-8-19-14(10-22(2,3)28-19)9-16(13)18-11-25-20(12-24-18)26-21(27)15-6-4-5-7-17(15)23;1-12-7-18-13(9-22(2,3)29-18)8-14(12)17-10-26-19(11-25-17)27-21(28)20-15(23)5-4-6-16(20)24;1-13-8-19-14(10-22(2,3)28-19)9-16(13)18-11-25-20(12-24-18)26-21(27)15-6-4-5-7-17(15)23/h4-11,13H,12H2,1-3H3,(H,25,26,27);4-10,12H,11H2,1-3H3,(H,26,27,28);4-11,13H,12H2,1-3H3,(H,25,26,27);4-9,11-12H,10H2,1-3H3,(H,25,26,27);4-8,10-11H,9H2,1-3H3,(H,26,27,28);4-9,11-12H,10H2,1-3H3,(H,25,26,27).
What are the key properties of 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide?
2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide has a molecular weight of 2330.44 g/mol, XLogP of 30.46, 18 rotatable bonds, 6 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-chloro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(2,2,6-trimethyl-3H-1-benzofuran-5-yl)-2-pyridinyl]benzamide is sourced from PubChem (CID 159849245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).