N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide

C119H110Cl2F9N27O10 — CID 159814326

About N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide

N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide (PubChem CID 159814326) has the molecular formula C119H110Cl2F9N27O10 and a molecular weight of 2320.26 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide.

Molecular Properties

• Compound Name: N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
• PubChem CID: 159814326
• Molecular Formula: C119H110Cl2F9N27O10
• Molecular Weight: 2320.26 g/mol
• Exact Mass: 2317.82
• IUPAC Name: N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide
• SMILES: CC(C)(N)CNC(=O)c1ccc(Nc2nc3cccc(-c4ccc(OC(F)(F)F)cc4)n3n2)cc1.CN(C)C(=O)c1ccc(Nc2nc3cccc(-c4ccc(OC(F)(F)F)cc4)n3n2)cc1.CN(C)CCNC(=O)c1ccc(Nc2nc3cccc(-c4ccc(OC(F)(F)F)cc4)n3n2)cc1.O=C(NC1CCCCC1O)c1ccc(Nc2nc3cccc(-c4cccc(Cl)c4)n3n2)cc1.O=C(c1ccc(Nc2nc3cccc(-c4cccc(Cl)c4)n3n2)cc1)N1CCC(O)CC1
• InChI: InChI=1S/C25H24ClN5O2.C24H22ClN5O2.2C24H23F3N6O2.C22H18F3N5O2/c26-18-6-3-5-17(15-18)21-8-4-10-23-29-25(30-31(21)23)27-19-13-11-16(12-14-19)24(33)28-20-7-1-2-9-22(20)32;25-18-4-1-3-17(15-18)21-5-2-6-22-27-24(28-30(21)22)26-19-9-7-16(8-10-19)23(32)29-13-11-20(31)12-14-29;1-32(2)15-14-28-22(34)17-6-10-18(11-7-17)29-23-30-21-5-3-4-20(33(21)31-23)16-8-12-19(13-9-16)35-24(25,26)27;1-23(2,28)14-29-21(34)16-6-10-17(11-7-16)30-22-31-20-5-3-4-19(33(20)32-22)15-8-12-18(13-9-15)35-24(25,26)27;1-29(2)20(31)15-6-10-16(11-7-15)26-21-27-19-5-3-4-18(30(19)28-21)14-8-12-17(13-9-14)32-22(23,24)25/h3-6,8,10-15,20,22,32H,1-2,7,9H2,(H,27,30)(H,28,33);1-10,15,20,31H,11-14H2,(H,26,28);3-13H,14-15H2,1-2H3,(H,28,34)(H,29,31);3-13H,14,28H2,1-2H3,(H,29,34)(H,30,32);3-13H,1-2H3,(H,26,28)
• InChIKey: NLKOYNYTYLCGHJ-UHFFFAOYSA-N
• XLogP: 22.79
• TPSA: 436.43 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 32
• Rotatable Bonds: 29
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2320.26
LogP ≤ 5	22.79
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide?

The IUPAC name of N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide (CID 159814326) is N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide.

What is the SMILES notation for N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide?

The canonical SMILES for N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide is CC(C)(N)CNC(=O)c1ccc(Nc2nc3cccc(-c4ccc(OC(F)(F)F)cc4)n3n2)cc1.CN(C)C(=O)c1ccc(Nc2nc3cccc(-c4ccc(OC(F)(F)F)cc4)n3n2)cc1.CN(C)CCNC(=O)c1ccc(Nc2nc3cccc(-c4ccc(OC(F)(F)F)cc4)n3n2)cc1.O=C(NC1CCCCC1O)c1ccc(Nc2nc3cccc(-c4cccc(Cl)c4)n3n2)cc1.O=C(c1ccc(Nc2nc3cccc(-c4cccc(Cl)c4)n3n2)cc1)N1CCC(O)CC1.

What is the InChIKey of N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide?

The InChIKey is NLKOYNYTYLCGHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24ClN5O2.C24H22ClN5O2.2C24H23F3N6O2.C22H18F3N5O2/c26-18-6-3-5-17(15-18)21-8-4-10-23-29-25(30-31(21)23)27-19-13-11-16(12-14-19)24(33)28-20-7-1-2-9-22(20)32;25-18-4-1-3-17(15-18)21-5-2-6-22-27-24(28-30(21)22)26-19-9-7-16(8-10-19)23(32)29-13-11-20(31)12-14-29;1-32(2)15-14-28-22(34)17-6-10-18(11-7-17)29-23-30-21-5-3-4-20(33(21)31-23)16-8-12-19(13-9-16)35-24(25,26)27;1-23(2,28)14-29-21(34)16-6-10-17(11-7-16)30-22-31-20-5-3-4-19(33(20)32-22)15-8-12-18(13-9-15)35-24(25,26)27;1-29(2)20(31)15-6-10-16(11-7-15)26-21-27-19-5-3-4-18(30(19)28-21)14-8-12-17(13-9-14)32-22(23,24)25/h3-6,8,10-15,20,22,32H,1-2,7,9H2,(H,27,30)(H,28,33);1-10,15,20,31H,11-14H2,(H,26,28);3-13H,14-15H2,1-2H3,(H,28,34)(H,29,31);3-13H,14,28H2,1-2H3,(H,29,34)(H,30,32);3-13H,1-2H3,(H,26,28).

What are the key properties of N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide?

N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide has a molecular weight of 2320.26 g/mol, XLogP of 22.79, 29 rotatable bonds, 11 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-amino-2-methylpropyl)-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(2-hydroxycyclohexyl)benzamide;[4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-(4-hydroxypiperidin-1-yl)methanone;N-[2-(dimethylamino)ethyl]-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide;N,N-dimethyl-4-[[5-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]benzamide is sourced from PubChem (CID 159814326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).