3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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

C63H51F6N9O6 — CID 158013002

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

3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 158013002) has the molecular formula C63H51F6N9O6 and a molecular weight of 1144.15 g/mol. Its IUPAC name is 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 Name: 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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: 158013002
• Molecular Formula: C63H51F6N9O6
• Molecular Weight: 1144.15 g/mol
• Exact Mass: 1143.39
• IUPAC Name: 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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
• SMILES: Cc1ccc(Cn2cc(NC(=O)c3ccoc3)c3ccccc32)cc1.Cc1ccc2c(c1)c(NC(=O)c1ccoc1)cn2Cc1ccc(C(F)(F)F)nc1.Cc1ccc2c(c1)c(NC(=O)c1conc1C)cn2Cc1ccc(C(F)(F)F)nc1
• InChI: InChI=1S/C21H17F3N4O2.C21H16F3N3O2.C21H18N2O2/c1-12-3-5-18-15(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;1-13-2-4-18-16(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/h3-8,10-11H,9H2,1-2H3,(H,26,29);2-9,11-12H,10H2,1H3,(H,26,28);2-11,13-14H,12H2,1H3,(H,22,24)
• InChIKey: FFCWZXIVKCTVFY-UHFFFAOYSA-N
• XLogP: 15.06
• TPSA: 180.18 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 12
• Rotatable Bonds: 12
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1144.15
LogP ≤ 5	15.06
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 158013002) is 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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)c1conc1C)cn2Cc1ccc(C(F)(F)F)nc1.

What is the InChIKey of 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 FFCWZXIVKCTVFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F3N4O2.C21H16F3N3O2.C21H18N2O2/c1-12-3-5-18-15(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;1-13-2-4-18-16(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/h3-8,10-11H,9H2,1-2H3,(H,26,29);2-9,11-12H,10H2,1H3,(H,26,28);2-11,13-14H,12H2,1H3,(H,22,24).

What are the key properties of 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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?

3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 1144.15 g/mol, XLogP of 15.06, 12 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methyl-N-[5-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indol-3-yl]-1,2-oxazole-4-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 158013002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).