2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine

C80H63F8N33O2 — CID 157448721

About 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine

2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine (PubChem CID 157448721) has the molecular formula C80H63F8N33O2 and a molecular weight of 1670.60 g/mol. Its IUPAC name is 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine.

Molecular Properties

• Compound Name: 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine
• PubChem CID: 157448721
• Molecular Formula: C80H63F8N33O2
• Molecular Weight: 1670.60 g/mol
• Exact Mass: 1669.57
• IUPAC Name: 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine
• SMILES: FC(F)c1cccc(-c2nc(Oc3ccccc3)c3cccn3n2)n1.Nc1cc(Nc2nc(-c3cccc(C(F)F)n3)nn3cccc23)ccn1.O=C(CN1CCCC1)Nc1cc(Nc2nc(-c3cccc(C(F)F)n3)nn3cccc23)ccn1.[N-]=[N+]=Nc1cc(N)ccn1.[N-]=[N+]=Nc1cc(Nc2nc(-c3cccc(C(F)F)n3)nn3cccc23)ccn1
• InChI: InChI=1S/C23H22F2N8O.C18H12F2N4O.C17H11F2N9.C17H13F2N7.C5H5N5/c24-21(25)16-5-3-6-17(28-16)22-30-23(18-7-4-12-33(18)31-22)27-15-8-9-26-19(13-15)29-20(34)14-32-10-1-2-11-32;19-16(20)13-8-4-9-14(21-13)17-22-18(15-10-5-11-24(15)23-17)25-12-6-2-1-3-7-12;18-15(19)11-3-1-4-12(23-11)16-24-17(13-5-2-8-28(13)26-16)22-10-6-7-21-14(9-10)25-27-20;18-15(19)11-3-1-4-12(23-11)16-24-17(13-5-2-8-26(13)25-16)22-10-6-7-21-14(20)9-10;6-4-1-2-8-5(3-4)9-10-7/h3-9,12-13,21H,1-2,10-11,14H2,(H2,26,27,29,30,31,34);1-11,16H;1-9,15H,(H,21,22,24,26);1-9,15H,(H3,20,21,22,24,25);1-3H,(H2,6,8)
• InChIKey: BSNRBLVNTPICBZ-UHFFFAOYSA-N
• XLogP: 18.29
• TPSA: 451.10 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 21
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1670.60
LogP ≤ 5	18.29
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine?

The IUPAC name of 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine (CID 157448721) is 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine.

What is the SMILES notation for 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine?

The canonical SMILES for 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine is FC(F)c1cccc(-c2nc(Oc3ccccc3)c3cccn3n2)n1.Nc1cc(Nc2nc(-c3cccc(C(F)F)n3)nn3cccc23)ccn1.O=C(CN1CCCC1)Nc1cc(Nc2nc(-c3cccc(C(F)F)n3)nn3cccc23)ccn1.[N-]=[N+]=Nc1cc(N)ccn1.[N-]=[N+]=Nc1cc(Nc2nc(-c3cccc(C(F)F)n3)nn3cccc23)ccn1.

What is the InChIKey of 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine?

The InChIKey is BSNRBLVNTPICBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22F2N8O.C18H12F2N4O.C17H11F2N9.C17H13F2N7.C5H5N5/c24-21(25)16-5-3-6-17(28-16)22-30-23(18-7-4-12-33(18)31-22)27-15-8-9-26-19(13-15)29-20(34)14-32-10-1-2-11-32;19-16(20)13-8-4-9-14(21-13)17-22-18(15-10-5-11-24(15)23-17)25-12-6-2-1-3-7-12;18-15(19)11-3-1-4-12(23-11)16-24-17(13-5-2-8-28(13)26-16)22-10-6-7-21-14(9-10)25-27-20;18-15(19)11-3-1-4-12(23-11)16-24-17(13-5-2-8-26(13)25-16)22-10-6-7-21-14(20)9-10;6-4-1-2-8-5(3-4)9-10-7/h3-9,12-13,21H,1-2,10-11,14H2,(H2,26,27,29,30,31,34);1-11,16H;1-9,15H,(H,21,22,24,26);1-9,15H,(H3,20,21,22,24,25);1-3H,(H2,6,8).

What are the key properties of 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine?

2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine has a molecular weight of 1670.60 g/mol, XLogP of 18.29, 21 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-azidopyridin-4-amine;N-(2-azido-4-pyridinyl)-2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine;2-[6-(difluoromethyl)-2-pyridinyl]-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;N-[4-[[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]-2-pyridinyl]-2-pyrrolidin-1-ylacetamide;4-N-[2-[6-(difluoromethyl)-2-pyridinyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]pyridine-2,4-diamine is sourced from PubChem (CID 157448721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).