5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide

C86H54Cl13FN18O9S2 — CID 159239883

IUPAC5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide
SMILESCc1c(C(=O)Nc2ccc(Cl)nc2)[nH]c2ccccc12.O=C(Nc1ccc(Cl)nc1)c1cc2cc(Cl)ccc2[nH]1.O=C(Nc1ccc(Cl)nc1)c1cc2cc(Cl)ccc2o1.O=C(Nc1ccc(Cl)nc1)c1cc2cc(F)ccc2[nH]1.O=C(Nc1ccc(Cl)nc1)c1ccc(Cl)o1.O=C(Nc1ccc(Cl)nc1)c1ccc(Cl)s1.O=C(Nc1ccc(Cl)nc1)c1nsc(Cl)c1Cl
InChIInChI=1S/C15H12ClN3O.C14H9Cl2N3O.C14H8Cl2N2O2.C14H9ClFN3O.C10H6Cl2N2O2.C10H6Cl2N2OS.C9H4Cl3N3OS/c1-9-11-4-2-3-5-12(11)19-14(9)15(20)18-10-6-7-13(16)17-8-10;15-9-1-3-11-8(5-9)6-12(19-11)14(20)18-10-2-4-13(16)17-7-10;15-9-1-3-11-8(5-9)6-12(20-11)14(19)18-10-2-4-13(16)17-7-10;15-13-4-2-10(7-17-13)18-14(20)12-6-8-5-9(16)1-3-11(8)19-12;2*11-8-3-1-6(5-13-8)14-10(15)7-2-4-9(12)16-7;10-5-2-1-4(3-13-5)14-9(16)7-6(11)8(12)17-15-7/h2-8,19H,1H3,(H,18,20);1-7,19H,(H,18,20);1-7H,(H,18,19);1-7,19H,(H,18,20);2*1-5H,(H,14,15);1-3H,(H,14,16)
InChIKeyKTYGVRNZIWSZJS-UHFFFAOYSA-N
MW2027.52 g/mol
LogP26.58
Rot. Bonds14

About 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide

5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide (PubChem CID 159239883) has the molecular formula C86H54Cl13FN18O9S2 and a molecular weight of 2027.52 g/mol. Its IUPAC name is 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide
PubChem CID159239883
Molecular FormulaC86H54Cl13FN18O9S2
Molecular Weight2027.52 g/mol
Exact Mass2019.97
IUPAC Name5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide
SMILESCc1c(C(=O)Nc2ccc(Cl)nc2)[nH]c2ccccc12.O=C(Nc1ccc(Cl)nc1)c1cc2cc(Cl)ccc2[nH]1.O=C(Nc1ccc(Cl)nc1)c1cc2cc(Cl)ccc2o1.O=C(Nc1ccc(Cl)nc1)c1cc2cc(F)ccc2[nH]1.O=C(Nc1ccc(Cl)nc1)c1ccc(Cl)o1.O=C(Nc1ccc(Cl)nc1)c1ccc(Cl)s1.O=C(Nc1ccc(Cl)nc1)c1nsc(Cl)c1Cl
InChIInChI=1S/C15H12ClN3O.C14H9Cl2N3O.C14H8Cl2N2O2.C14H9ClFN3O.C10H6Cl2N2O2.C10H6Cl2N2OS.C9H4Cl3N3OS/c1-9-11-4-2-3-5-12(11)19-14(9)15(20)18-10-6-7-13(16)17-8-10;15-9-1-3-11-8(5-9)6-12(19-11)14(20)18-10-2-4-13(16)17-7-10;15-9-1-3-11-8(5-9)6-12(20-11)14(19)18-10-2-4-13(16)17-7-10;15-13-4-2-10(7-17-13)18-14(20)12-6-8-5-9(16)1-3-11(8)19-12;2*11-8-3-1-6(5-13-8)14-10(15)7-2-4-9(12)16-7;10-5-2-1-4(3-13-5)14-9(16)7-6(11)8(12)17-15-7/h2-8,19H,1H3,(H,18,20);1-7,19H,(H,18,20);1-7H,(H,18,19);1-7,19H,(H,18,20);2*1-5H,(H,14,15);1-3H,(H,14,16)
InChIKeyKTYGVRNZIWSZJS-UHFFFAOYSA-N
XLogP26.58
TPSA380.47 Ų
H-Bond Donors10
H-Bond Acceptors19
Rotatable Bonds14
Heavy Atoms129
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002027.52
LogP ≤ 526.58
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

5-chloro-N-(2-chloropyrimidin-5-yl)-1-benzofuran-2-carboxamide;5-chloro-N-(2-chloropyrimidin-5-yl)-1H-indole-2-carboxamide;5-chloro-N-(2-chloropyrimidin-5-yl)thiophene-2-carboxamide;N-(2-chloropyrimidin-5-yl)-1-benzothiophene-2-carboxamide;N-(2-chloropyrimidin-5-yl)-3-cyano-4-fluorobenzamide;N-(2-chloropyrimidin-5-yl)-5-fluoro-1H-indole-2-carboxamide;N-(2-chloropyrimidin-5-yl)-1H-indole-2-carboxamide;5-fluoro-N-(2-methylpyrimidin-5-yl)-1H-indole-2-carboxamide
CID 158899113

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide?
The IUPAC name of 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide (CID 159239883) is 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide?
The canonical SMILES for 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide is Cc1c(C(=O)Nc2ccc(Cl)nc2)[nH]c2ccccc12.O=C(Nc1ccc(Cl)nc1)c1cc2cc(Cl)ccc2[nH]1.O=C(Nc1ccc(Cl)nc1)c1cc2cc(Cl)ccc2o1.O=C(Nc1ccc(Cl)nc1)c1cc2cc(F)ccc2[nH]1.O=C(Nc1ccc(Cl)nc1)c1ccc(Cl)o1.O=C(Nc1ccc(Cl)nc1)c1ccc(Cl)s1.O=C(Nc1ccc(Cl)nc1)c1nsc(Cl)c1Cl.
What is the InChIKey of 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide?
The InChIKey is KTYGVRNZIWSZJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O.C14H9Cl2N3O.C14H8Cl2N2O2.C14H9ClFN3O.C10H6Cl2N2O2.C10H6Cl2N2OS.C9H4Cl3N3OS/c1-9-11-4-2-3-5-12(11)19-14(9)15(20)18-10-6-7-13(16)17-8-10;15-9-1-3-11-8(5-9)6-12(19-11)14(20)18-10-2-4-13(16)17-7-10;15-9-1-3-11-8(5-9)6-12(20-11)14(19)18-10-2-4-13(16)17-7-10;15-13-4-2-10(7-17-13)18-14(20)12-6-8-5-9(16)1-3-11(8)19-12;2*11-8-3-1-6(5-13-8)14-10(15)7-2-4-9(12)16-7;10-5-2-1-4(3-13-5)14-9(16)7-6(11)8(12)17-15-7/h2-8,19H,1H3,(H,18,20);1-7,19H,(H,18,20);1-7H,(H,18,19);1-7,19H,(H,18,20);2*1-5H,(H,14,15);1-3H,(H,14,16).
What are the key properties of 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide?
5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide has a molecular weight of 2027.52 g/mol, XLogP of 26.58, 14 rotatable bonds, 10 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(6-chloro-3-pyridinyl)-1-benzofuran-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)furan-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)-1H-indole-2-carboxamide;5-chloro-N-(6-chloro-3-pyridinyl)thiophene-2-carboxamide;N-(6-chloro-3-pyridinyl)-5-fluoro-1H-indole-2-carboxamide;N-(6-chloro-3-pyridinyl)-3-methyl-1H-indole-2-carboxamide;4,5-dichloro-N-(6-chloro-3-pyridinyl)-1,2-thiazole-3-carboxamide is sourced from PubChem (CID 159239883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).