N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide

C127H105F3N18O8 — CID 163685830

IUPACN-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide
SMILESCc1ccc(Cn2cc(NC(=O)c3ccccn3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cccnc3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cnccn3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cncnc3)c3ccccc32)cc1.O=C(Nc1cn(Cc2ccccc2)c2ccccc12)c1ccoc1.O=C(Nc1cn(Cc2ccccc2C(F)(F)F)c2ccccc12)c1ccoc1
InChIInChI=1S/2C22H19N3O.C21H15F3N2O2.2C21H18N4O.C20H16N2O2/c1-16-9-11-17(12-10-16)14-25-15-20(18-6-2-3-8-21(18)25)24-22(26)19-7-4-5-13-23-19;1-16-8-10-17(11-9-16)14-25-15-20(19-6-2-3-7-21(19)25)24-22(26)18-5-4-12-23-13-18;22-21(23,24)17-7-3-1-5-14(17)11-26-12-18(16-6-2-4-8-19(16)26)25-20(27)15-9-10-28-13-15;1-15-6-8-16(9-7-15)12-25-13-19(18-4-2-3-5-20(18)25)24-21(26)17-10-22-14-23-11-17;1-15-6-8-16(9-7-15)13-25-14-19(17-4-2-3-5-20(17)25)24-21(26)18-12-22-10-11-23-18;23-20(16-10-11-24-14-16)21-18-13-22(12-15-6-2-1-3-7-15)19-9-5-4-8-17(18)19/h2*2-13,15H,14H2,1H3,(H,24,26);1-10,12-13H,11H2,(H,25,27);2-11,13-14H,12H2,1H3,(H,24,26);2-12,14H,13H2,1H3,(H,24,26);1-11,13-14H,12H2,(H,21,23)
InChIKeyJOULQBVXSPXPRK-UHFFFAOYSA-N
MW2068.35 g/mol
LogP27.46
Rot. Bonds24

About N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide

N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide (PubChem CID 163685830) has the molecular formula C127H105F3N18O8 and a molecular weight of 2068.35 g/mol. Its IUPAC name is N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide.

Molecular Properties

Compound NameN-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide
PubChem CID163685830
Molecular FormulaC127H105F3N18O8
Molecular Weight2068.35 g/mol
Exact Mass2066.83
IUPAC NameN-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide
SMILESCc1ccc(Cn2cc(NC(=O)c3ccccn3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cccnc3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cnccn3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cncnc3)c3ccccc32)cc1.O=C(Nc1cn(Cc2ccccc2)c2ccccc12)c1ccoc1.O=C(Nc1cn(Cc2ccccc2C(F)(F)F)c2ccccc12)c1ccoc1
InChIInChI=1S/2C22H19N3O.C21H15F3N2O2.2C21H18N4O.C20H16N2O2/c1-16-9-11-17(12-10-16)14-25-15-20(18-6-2-3-8-21(18)25)24-22(26)19-7-4-5-13-23-19;1-16-8-10-17(11-9-16)14-25-15-20(19-6-2-3-7-21(19)25)24-22(26)18-5-4-12-23-13-18;22-21(23,24)17-7-3-1-5-14(17)11-26-12-18(16-6-2-4-8-19(16)26)25-20(27)15-9-10-28-13-15;1-15-6-8-16(9-7-15)12-25-13-19(18-4-2-3-5-20(18)25)24-21(26)17-10-22-14-23-11-17;1-15-6-8-16(9-7-15)13-25-14-19(17-4-2-3-5-20(17)25)24-21(26)18-12-22-10-11-23-18;23-20(16-10-11-24-14-16)21-18-13-22(12-15-6-2-1-3-7-15)19-9-5-4-8-17(18)19/h2*2-13,15H,14H2,1H3,(H,24,26);1-10,12-13H,11H2,(H,25,27);2-11,13-14H,12H2,1H3,(H,24,26);2-12,14H,13H2,1H3,(H,24,26);1-11,13-14H,12H2,(H,21,23)
InChIKeyJOULQBVXSPXPRK-UHFFFAOYSA-N
XLogP27.46
TPSA307.80 Ų
H-Bond Donors6
H-Bond Acceptors20
Rotatable Bonds24
Heavy Atoms156
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002068.35
LogP ≤ 527.46
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1020

Analyze N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide?
The IUPAC name of N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide (CID 163685830) is N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide.
What is the SMILES notation for N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide?
The canonical SMILES for N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide is Cc1ccc(Cn2cc(NC(=O)c3ccccn3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cccnc3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cnccn3)c3ccccc32)cc1.Cc1ccc(Cn2cc(NC(=O)c3cncnc3)c3ccccc32)cc1.O=C(Nc1cn(Cc2ccccc2)c2ccccc12)c1ccoc1.O=C(Nc1cn(Cc2ccccc2C(F)(F)F)c2ccccc12)c1ccoc1.
What is the InChIKey of N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide?
The InChIKey is JOULQBVXSPXPRK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H19N3O.C21H15F3N2O2.2C21H18N4O.C20H16N2O2/c1-16-9-11-17(12-10-16)14-25-15-20(18-6-2-3-8-21(18)25)24-22(26)19-7-4-5-13-23-19;1-16-8-10-17(11-9-16)14-25-15-20(19-6-2-3-7-21(19)25)24-22(26)18-5-4-12-23-13-18;22-21(23,24)17-7-3-1-5-14(17)11-26-12-18(16-6-2-4-8-19(16)26)25-20(27)15-9-10-28-13-15;1-15-6-8-16(9-7-15)12-25-13-19(18-4-2-3-5-20(18)25)24-21(26)17-10-22-14-23-11-17;1-15-6-8-16(9-7-15)13-25-14-19(17-4-2-3-5-20(17)25)24-21(26)18-12-22-10-11-23-18;23-20(16-10-11-24-14-16)21-18-13-22(12-15-6-2-1-3-7-15)19-9-5-4-8-17(18)19/h2*2-13,15H,14H2,1H3,(H,24,26);1-10,12-13H,11H2,(H,25,27);2-11,13-14H,12H2,1H3,(H,24,26);2-12,14H,13H2,1H3,(H,24,26);1-11,13-14H,12H2,(H,21,23).
What are the key properties of N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide?
N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide has a molecular weight of 2068.35 g/mol, XLogP of 27.46, 24 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylindol-3-yl)furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrazine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyridine-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]pyrimidine-5-carboxamide;N-[1-[[2-(trifluoromethyl)phenyl]methyl]indol-3-yl]furan-3-carboxamide is sourced from PubChem (CID 163685830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).