N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate

C125H111Br3Cl4F6N24O8S4 — CID 159653648

IUPACN-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate
SMILESCc1ccc(C(=O)Nc2ccc(-c3c(F)cc(F)cc3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cnc(Cl)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sc(Br)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sc(Cl)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2nc(N)c(-c3sc(Br)cc3C)cc2Br)cc1.Cc1ccc(C(=O)Nc2nc(N)c(-c3sc(Cl)cc3C)cc2Cl)cc1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)OC(C)(C)C)nc1N
InChIInChI=1S/C19H17ClN4O.C19H14F3N3O.C18H15Br2N3OS.C18H16BrN3OS.C18H15Cl2N3OS.C18H16ClN3OS.C15H18F3N5O2/c1-11-3-5-13(6-4-11)19(25)24-17-8-7-14(18(21)23-17)15-10-22-16(20)9-12(15)2;1-10-2-4-11(5-3-10)19(26)25-16-7-6-13(18(23)24-16)17-14(21)8-12(20)9-15(17)22;1-9-3-5-11(6-4-9)18(24)23-17-13(19)8-12(16(21)22-17)15-10(2)7-14(20)25-15;1-10-3-5-12(6-4-10)18(23)22-15-8-7-13(17(20)21-15)16-11(2)9-14(19)24-16;1-9-3-5-11(6-4-9)18(24)23-17-13(19)8-12(16(21)22-17)15-10(2)7-14(20)25-15;1-10-3-5-12(6-4-10)18(23)22-15-8-7-13(17(20)21-15)16-11(2)9-14(19)24-16;1-14(2,3)25-13(24)21-11-6-5-8(12(19)20-11)9-7-10(15(16,17)18)22-23(9)4/h3-10H,1-2H3,(H3,21,23,24,25);2-9H,1H3,(H3,23,24,25,26);3-8H,1-2H3,(H3,21,22,23,24);3-9H,1-2H3,(H3,20,21,22,23);3-8H,1-2H3,(H3,21,22,23,24);3-9H,1-2H3,(H3,20,21,22,23);5-7H,1-4H3,(H3,19,20,21,24)
InChIKeyMRWXDNOVGBJHRL-UHFFFAOYSA-N
MW2701.20 g/mol
LogP33.28
Rot. Bonds20

About N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate

N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate (PubChem CID 159653648) has the molecular formula C125H111Br3Cl4F6N24O8S4 and a molecular weight of 2701.20 g/mol. Its IUPAC name is N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate.

Molecular Properties

Compound NameN-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate
PubChem CID159653648
Molecular FormulaC125H111Br3Cl4F6N24O8S4
Molecular Weight2701.20 g/mol
Exact Mass2694.41
IUPAC NameN-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate
SMILESCc1ccc(C(=O)Nc2ccc(-c3c(F)cc(F)cc3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cnc(Cl)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sc(Br)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sc(Cl)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2nc(N)c(-c3sc(Br)cc3C)cc2Br)cc1.Cc1ccc(C(=O)Nc2nc(N)c(-c3sc(Cl)cc3C)cc2Cl)cc1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)OC(C)(C)C)nc1N
InChIInChI=1S/C19H17ClN4O.C19H14F3N3O.C18H15Br2N3OS.C18H16BrN3OS.C18H15Cl2N3OS.C18H16ClN3OS.C15H18F3N5O2/c1-11-3-5-13(6-4-11)19(25)24-17-8-7-14(18(21)23-17)15-10-22-16(20)9-12(15)2;1-10-2-4-11(5-3-10)19(26)25-16-7-6-13(18(23)24-16)17-14(21)8-12(20)9-15(17)22;1-9-3-5-11(6-4-9)18(24)23-17-13(19)8-12(16(21)22-17)15-10(2)7-14(20)25-15;1-10-3-5-12(6-4-10)18(23)22-15-8-7-13(17(20)21-15)16-11(2)9-14(19)24-16;1-9-3-5-11(6-4-9)18(24)23-17-13(19)8-12(16(21)22-17)15-10(2)7-14(20)25-15;1-10-3-5-12(6-4-10)18(23)22-15-8-7-13(17(20)21-15)16-11(2)9-14(19)24-16;1-14(2,3)25-13(24)21-11-6-5-8(12(19)20-11)9-7-10(15(16,17)18)22-23(9)4/h3-10H,1-2H3,(H3,21,23,24,25);2-9H,1H3,(H3,23,24,25,26);3-8H,1-2H3,(H3,21,22,23,24);3-9H,1-2H3,(H3,20,21,22,23);3-8H,1-2H3,(H3,21,22,23,24);3-9H,1-2H3,(H3,20,21,22,23);5-7H,1-4H3,(H3,19,20,21,24)
InChIKeyMRWXDNOVGBJHRL-UHFFFAOYSA-N
XLogP33.28
TPSA516.01 Ų
H-Bond Donors14
H-Bond Acceptors29
Rotatable Bonds20
Heavy Atoms174
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002701.20
LogP ≤ 533.28
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate with MolForge

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Related Compounds

N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3,6-dimethoxypyridazin-4-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-methoxy-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate
CID 157140544
2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]benzamide;2,6-difluoro-N-[5-(5-formyl-3-methylthiophen-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]benzamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;4-methyl-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]benzamide
CID 159695658
N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate
CID 161570512
N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chlorothiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3,6-dimethoxypyridazin-4-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-methoxy-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate
CID 161898562
2-chloro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(5-formyl-3-methylthiophen-2-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]benzamide;2-fluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;4-methyl-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]benzamide
CID 162261543
3-[(4-carbamimidoyl-2-fluorobenzoyl)amino]-N-(5-chloro-2-pyridinyl)thiophene-2-carboxamide;bis(N-(5-chloro-2-pyridinyl)-3-[(4-ethanimidoyl-2-fluorobenzoyl)amino]thiophene-2-carboxamide);N-(5-chloro-2-pyridinyl)-3-[[2-fluoro-4-(piperidine-1-carboximidoyl)benzoyl]amino]thiophene-2-carboxamide;N-(5-chloro-2-pyridinyl)-3-[[2-fluoro-4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]thiophene-2-carboxamide
CID 90748593
N-(5-chloro-3-fluoro-2-pyridinyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2-chlorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(3,5-difluoro-4-pyridinyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(2-fluorophenyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(3-fluoro-2-pyridinyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide;N-(3-fluoro-4-pyridinyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide
CID 160333579
N-(5-chloro-3-fluoro-2-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-chlorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(3,5-difluoro-4-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;N-(2-fluorophenyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide;5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-4-pyridinyl)thiophene-2-carboxamide
CID 162164826

Frequently Asked Questions

What is the IUPAC name of N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate?
The IUPAC name of N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate (CID 159653648) is N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate.
What is the SMILES notation for N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate?
The canonical SMILES for N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate is Cc1ccc(C(=O)Nc2ccc(-c3c(F)cc(F)cc3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cnc(Cl)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sc(Br)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3sc(Cl)cc3C)c(N)n2)cc1.Cc1ccc(C(=O)Nc2nc(N)c(-c3sc(Br)cc3C)cc2Br)cc1.Cc1ccc(C(=O)Nc2nc(N)c(-c3sc(Cl)cc3C)cc2Cl)cc1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)OC(C)(C)C)nc1N.
What is the InChIKey of N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate?
The InChIKey is MRWXDNOVGBJHRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O.C19H14F3N3O.C18H15Br2N3OS.C18H16BrN3OS.C18H15Cl2N3OS.C18H16ClN3OS.C15H18F3N5O2/c1-11-3-5-13(6-4-11)19(25)24-17-8-7-14(18(21)23-17)15-10-22-16(20)9-12(15)2;1-10-2-4-11(5-3-10)19(26)25-16-7-6-13(18(23)24-16)17-14(21)8-12(20)9-15(17)22;1-9-3-5-11(6-4-9)18(24)23-17-13(19)8-12(16(21)22-17)15-10(2)7-14(20)25-15;1-10-3-5-12(6-4-10)18(23)22-15-8-7-13(17(20)21-15)16-11(2)9-14(19)24-16;1-9-3-5-11(6-4-9)18(24)23-17-13(19)8-12(16(21)22-17)15-10(2)7-14(20)25-15;1-10-3-5-12(6-4-10)18(23)22-15-8-7-13(17(20)21-15)16-11(2)9-14(19)24-16;1-14(2,3)25-13(24)21-11-6-5-8(12(19)20-11)9-7-10(15(16,17)18)22-23(9)4/h3-10H,1-2H3,(H3,21,23,24,25);2-9H,1H3,(H3,23,24,25,26);3-8H,1-2H3,(H3,21,22,23,24);3-9H,1-2H3,(H3,20,21,22,23);3-8H,1-2H3,(H3,21,22,23,24);3-9H,1-2H3,(H3,20,21,22,23);5-7H,1-4H3,(H3,19,20,21,24).
What are the key properties of N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate?
N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate has a molecular weight of 2701.20 g/mol, XLogP of 33.28, 20 rotatable bonds, 14 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-3-chloro-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2,4,6-trifluorophenyl)-2-pyridinyl]-4-methylbenzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate is sourced from PubChem (CID 159653648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).