4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide — IUPAC name, SMILES, InChIKey & properties

Name: 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

About 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide

4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide (PubChem CID 161016710) has the molecular formula C81H67F6N17O6S and a molecular weight of 1520.59 g/mol. Its IUPAC name is 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name	4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide
PubChem CID	161016710
Molecular Formula	C81H67F6N17O6S
Molecular Weight	1520.59 g/mol
Exact Mass	1519.51
IUPAC Name	4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide
SMILES	Cc1ccc(Cn2nc(NC(=O)c3cccnn3)c3ccccc32)cc1.Cc1ccc(Cn2nc(NC(=O)c3scnc3C)c3ccccc32)cc1.Cc1ccc2c(NC(=O)c3ccoc3C)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.Cc1ocnc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12
InChI	InChI=1S/C21H17F3N4O2.C20H15F3N4O2.C20H17N5O.C20H18N4OS/c1-12-3-8-17-18(26-20(29)16-9-10-30-13(16)2)27-28(19(17)25-12)11-14-4-6-15(7-5-14)21(22,23)24;1-12-17(24-11-29-12)19(28)25-18-15-4-2-3-5-16(15)27(26-18)10-13-6-8-14(9-7-13)20(21,22)23;1-14-8-10-15(11-9-14)13-25-18-7-3-2-5-16(18)19(24-25)22-20(26)17-6-4-12-21-23-17;1-13-7-9-15(10-8-13)11-24-17-6-4-3-5-16(17)19(23-24)22-20(25)18-14(2)21-12-26-18/h3-10H,11H2,1-2H3,(H,26,27,29);2-9,11H,10H2,1H3,(H,25,26,28);2-12H,13H2,1H3,(H,22,24,26);3-10,12H,11H2,1-2H3,(H,22,23,25)
InChIKey	TXUYDUWEKJGWAG-UHFFFAOYSA-N
XLogP	17.46
TPSA	278.41 Å²
H-Bond Donors	4
H-Bond Acceptors	20
Rotatable Bonds	16
Heavy Atoms	111
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1520.59
LogP ≤ 5	17.46
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	20

Analyze 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide?

The IUPAC name of 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide (CID 161016710) is 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide.

What is the SMILES notation for 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide?

The canonical SMILES for 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide is Cc1ccc(Cn2nc(NC(=O)c3cccnn3)c3ccccc32)cc1.Cc1ccc(Cn2nc(NC(=O)c3scnc3C)c3ccccc32)cc1.Cc1ccc2c(NC(=O)c3ccoc3C)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.Cc1ocnc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.

What is the InChIKey of 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide?

The InChIKey is TXUYDUWEKJGWAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F3N4O2.C20H15F3N4O2.C20H17N5O.C20H18N4OS/c1-12-3-8-17-18(26-20(29)16-9-10-30-13(16)2)27-28(19(17)25-12)11-14-4-6-15(7-5-14)21(22,23)24;1-12-17(24-11-29-12)19(28)25-18-15-4-2-3-5-16(15)27(26-18)10-13-6-8-14(9-7-13)20(21,22)23;1-14-8-10-15(11-9-14)13-25-18-7-3-2-5-16(18)19(24-25)22-20(26)17-6-4-12-21-23-17;1-13-7-9-15(10-8-13)11-24-17-6-4-3-5-16(17)19(23-24)22-20(25)18-14(2)21-12-26-18/h3-10H,11H2,1-2H3,(H,26,27,29);2-9,11H,10H2,1H3,(H,25,26,28);2-12H,13H2,1H3,(H,22,24,26);3-10,12H,11H2,1-2H3,(H,22,23,25).

What are the key properties of 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide?

Where does this data come from?

All data for 4-methyl-N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide;2-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]furan-3-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]pyridazine-3-carboxamide;5-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 161016710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).