2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide

C106H86F12N16O9S — CID 159709988

IUPAC2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide
SMILESCc1ccc(Cn2cc(NC(=O)c3ccoc3)c3ccccc32)cc1.Cc1ccc2c(c1)c(NC(=O)c1ccoc1)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1ccoc1C)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1conc1C)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1scnc1C)cn2Cc1ccc(C(F)(F)F)nc1
InChIInChI=1S/C22H18F3N3O2.C21H17F3N4O2.C21H17F3N4OS.C21H16F3N3O2.C21H18N2O2/c1-13-3-5-19-17(9-13)18(27-21(29)16-7-8-30-14(16)2)12-28(19)11-15-4-6-20(26-10-15)22(23,24)25;1-12-3-5-18-15(7-12)17(26-20(29)16-11-30-27-13(16)2)10-28(18)9-14-4-6-19(25-8-14)21(22,23)24;1-12-3-5-17-15(7-12)16(27-20(29)19-13(2)26-11-30-19)10-28(17)9-14-4-6-18(25-8-14)21(22,23)24;1-13-2-4-18-16(8-13)17(26-20(28)15-6-7-29-12-15)11-27(18)10-14-3-5-19(25-9-14)21(22,23)24;1-15-6-8-16(9-7-15)12-23-13-19(18-4-2-3-5-20(18)23)22-21(24)17-10-11-25-14-17/h3-10,12H,11H2,1-2H3,(H,27,29);3-8,10-11H,9H2,1-2H3,(H,26,29);3-8,10-11H,9H2,1-2H3,(H,27,29);2-9,11-12H,10H2,1H3,(H,26,28);2-11,13-14H,12H2,1H3,(H,22,24)
InChIKeyMYSDJWXZVFYJGT-UHFFFAOYSA-N
MW1988.00 g/mol
LogP26.06
Rot. Bonds20

About 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide

2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide (PubChem CID 159709988) has the molecular formula C106H86F12N16O9S and a molecular weight of 1988.00 g/mol. Its IUPAC name is 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide
PubChem CID159709988
Molecular FormulaC106H86F12N16O9S
Molecular Weight1988.00 g/mol
Exact Mass1986.63
IUPAC Name2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide
SMILESCc1ccc(Cn2cc(NC(=O)c3ccoc3)c3ccccc32)cc1.Cc1ccc2c(c1)c(NC(=O)c1ccoc1)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1ccoc1C)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1conc1C)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1scnc1C)cn2Cc1ccc(C(F)(F)F)nc1
InChIInChI=1S/C22H18F3N3O2.C21H17F3N4O2.C21H17F3N4OS.C21H16F3N3O2.C21H18N2O2/c1-13-3-5-19-17(9-13)18(27-21(29)16-7-8-30-14(16)2)12-28(19)11-15-4-6-20(26-10-15)22(23,24)25;1-12-3-5-18-15(7-12)17(26-20(29)16-11-30-27-13(16)2)10-28(18)9-14-4-6-19(25-8-14)21(22,23)24;1-12-3-5-17-15(7-12)16(27-20(29)19-13(2)26-11-30-19)10-28(17)9-14-4-6-18(25-8-14)21(22,23)24;1-13-2-4-18-16(8-13)17(26-20(28)15-6-7-29-12-15)11-27(18)10-14-3-5-19(25-9-14)21(22,23)24;1-15-6-8-16(9-7-15)12-23-13-19(18-4-2-3-5-20(18)23)22-21(24)17-10-11-25-14-17/h3-10,12H,11H2,1-2H3,(H,27,29);3-8,10-11H,9H2,1-2H3,(H,26,29);3-8,10-11H,9H2,1-2H3,(H,27,29);2-9,11-12H,10H2,1H3,(H,26,28);2-11,13-14H,12H2,1H3,(H,22,24)
InChIKeyMYSDJWXZVFYJGT-UHFFFAOYSA-N
XLogP26.06
TPSA300.05 Ų
H-Bond Donors5
H-Bond Acceptors21
Rotatable Bonds20
Heavy Atoms144
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001988.00
LogP ≤ 526.06
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1021

Analyze 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide (CID 159709988) is 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide is Cc1ccc(Cn2cc(NC(=O)c3ccoc3)c3ccccc32)cc1.Cc1ccc2c(c1)c(NC(=O)c1ccoc1)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1ccoc1C)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1conc1C)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1scnc1C)cn2Cc1ccc(C(F)(F)F)nc1.
What is the InChIKey of 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide?
The InChIKey is MYSDJWXZVFYJGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18F3N3O2.C21H17F3N4O2.C21H17F3N4OS.C21H16F3N3O2.C21H18N2O2/c1-13-3-5-19-17(9-13)18(27-21(29)16-7-8-30-14(16)2)12-28(19)11-15-4-6-20(26-10-15)22(23,24)25;1-12-3-5-18-15(7-12)17(26-20(29)16-11-30-27-13(16)2)10-28(18)9-14-4-6-19(25-8-14)21(22,23)24;1-12-3-5-17-15(7-12)16(27-20(29)19-13(2)26-11-30-19)10-28(17)9-14-4-6-18(25-8-14)21(22,23)24;1-13-2-4-18-16(8-13)17(26-20(28)15-6-7-29-12-15)11-27(18)10-14-3-5-19(25-9-14)21(22,23)24;1-15-6-8-16(9-7-15)12-23-13-19(18-4-2-3-5-20(18)23)22-21(24)17-10-11-25-14-17/h3-10,12H,11H2,1-2H3,(H,27,29);3-8,10-11H,9H2,1-2H3,(H,26,29);3-8,10-11H,9H2,1-2H3,(H,27,29);2-9,11-12H,10H2,1H3,(H,26,28);2-11,13-14H,12H2,1H3,(H,22,24).
What are the key properties of 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide?
2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide has a molecular weight of 1988.00 g/mol, XLogP of 26.06, 20 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide;3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,3-thiazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indol-3-yl]furan-3-carboxamide;N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]furan-3-carboxamide is sourced from PubChem (CID 159709988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).