4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol

C107H113ClN28O6 — CID 159019948

About 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol

4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol (PubChem CID 159019948) has the molecular formula C107H113ClN28O6 and a molecular weight of 1922.72 g/mol. Its IUPAC name is 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol.

Molecular Properties

• Compound Name: 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol
• PubChem CID: 159019948
• Molecular Formula: C107H113ClN28O6
• Molecular Weight: 1922.72 g/mol
• Exact Mass: 1920.91
• IUPAC Name: 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol
• SMILES: C.CC(C)Cn1cc(-c2cccc3nc(N)nn23)cn1.CC(C)c1cccc(-c2cccc3nc(Nc4ccnc(CO)c4)nn23)c1.COc1cccc(-c2cccc3nc(Nc4ccc(C(=O)NCCCN5CCOCC5)cc4)nn23)c1.Cc1cc(Nc2nc3cccc(-c4ccc(C(C)C)cc4)n3n2)ccn1.O=C(CNC(=O)c1ccc(Nc2nc3cccc(-c4cccc(Cl)c4)n3n2)cc1)NC1CC1
• InChI: InChI=1S/C27H30N6O3.C24H21ClN6O2.C21H21N5O.C21H21N5.C13H16N6.CH4/c1-35-23-6-2-5-21(19-23)24-7-3-8-25-30-27(31-33(24)25)29-22-11-9-20(10-12-22)26(34)28-13-4-14-32-15-17-36-18-16-32;25-17-4-1-3-16(13-17)20-5-2-6-21-29-24(30-31(20)21)28-19-9-7-15(8-10-19)23(33)26-14-22(32)27-18-11-12-18;1-14(2)15-5-3-6-16(11-15)19-7-4-8-20-24-21(25-26(19)20)23-17-9-10-22-18(12-17)13-27;1-14(2)16-7-9-17(10-8-16)19-5-4-6-20-24-21(25-26(19)20)23-18-11-12-22-15(3)13-18;1-9(2)7-18-8-10(6-15-18)11-4-3-5-12-16-13(14)17-19(11)12;/h2-3,5-12,19H,4,13-18H2,1H3,(H,28,34)(H,29,31);1-10,13,18H,11-12,14H2,(H,26,33)(H,27,32)(H,28,30);3-12,14,27H,13H2,1-2H3,(H,22,23,25);4-14H,1-3H3,(H,22,23,25);3-6,8-9H,7H2,1-2H3,(H2,14,17);1H4
• InChIKey: JTOGPRSOFLYEDI-UHFFFAOYSA-N
• XLogP: 18.99
• TPSA: 397.92 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 31
• Rotatable Bonds: 28
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1922.72
LogP ≤ 5	18.99
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?

The IUPAC name of 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol (CID 159019948) is 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol.

What is the SMILES notation for 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?

The canonical SMILES for 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol is C.CC(C)Cn1cc(-c2cccc3nc(N)nn23)cn1.CC(C)c1cccc(-c2cccc3nc(Nc4ccnc(CO)c4)nn23)c1.COc1cccc(-c2cccc3nc(Nc4ccc(C(=O)NCCCN5CCOCC5)cc4)nn23)c1.Cc1cc(Nc2nc3cccc(-c4ccc(C(C)C)cc4)n3n2)ccn1.O=C(CNC(=O)c1ccc(Nc2nc3cccc(-c4cccc(Cl)c4)n3n2)cc1)NC1CC1.

What is the InChIKey of 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?

The InChIKey is JTOGPRSOFLYEDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N6O3.C24H21ClN6O2.C21H21N5O.C21H21N5.C13H16N6.CH4/c1-35-23-6-2-5-21(19-23)24-7-3-8-25-30-27(31-33(24)25)29-22-11-9-20(10-12-22)26(34)28-13-4-14-32-15-17-36-18-16-32;25-17-4-1-3-16(13-17)20-5-2-6-21-29-24(30-31(20)21)28-19-9-7-15(8-10-19)23(33)26-14-22(32)27-18-11-12-18;1-14(2)15-5-3-6-16(11-15)19-7-4-8-20-24-21(25-26(19)20)23-17-9-10-22-18(12-17)13-27;1-14(2)16-7-9-17(10-8-16)19-5-4-6-20-24-21(25-26(19)20)23-18-11-12-22-15(3)13-18;1-9(2)7-18-8-10(6-15-18)11-4-3-5-12-16-13(14)17-19(11)12;/h2-3,5-12,19H,4,13-18H2,1H3,(H,28,34)(H,29,31);1-10,13,18H,11-12,14H2,(H,26,33)(H,27,32)(H,28,30);3-12,14,27H,13H2,1-2H3,(H,22,23,25);4-14H,1-3H3,(H,22,23,25);3-6,8-9H,7H2,1-2H3,(H2,14,17);1H4.

What are the key properties of 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?

4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol has a molecular weight of 1922.72 g/mol, XLogP of 18.99, 28 rotatable bonds, 9 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-[2-(cyclopropylamino)-2-oxoethyl]benzamide;methane;4-[[5-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-N-(3-morpholin-4-ylpropyl)benzamide;5-[1-(2-methylpropyl)pyrazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(4-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;[4-[[5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol is sourced from PubChem (CID 159019948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).