2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine

C201H245F12N37 — CID 158214799

About 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine

2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 158214799) has the molecular formula C201H245F12N37 and a molecular weight of 3407.41 g/mol. Its IUPAC name is 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

• Compound Name: 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
• PubChem CID: 158214799
• Molecular Formula: C201H245F12N37
• Molecular Weight: 3407.41 g/mol
• Exact Mass: 3405.01
• IUPAC Name: 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
• SMILES: CC(C)(C)c1cc2n(n1)CCCC2c1ccccc1.CC(C)(C)c1cc2n(n1)CCCC2c1ccccc1F.CC(C)(C)c1nc2n(n1)C(c1ccccc1)CC2(F)F.CC(C)(C)c1nc2n(n1)C(c1ccccc1F)CC2.CC(C)(C)c1nc2n(n1)CCC2c1ccccc1.CC(C)(C)c1nc2n(n1)CCC2c1ccccc1F.CC(C)(C)c1nc2n(n1)CCCC2c1ccccc1.CC(C)(C)c1nc2n(n1)CCCC2c1ccccc1F.CC(C)(C)c1nc2n(n1)[C@@H](c1ccccc1)CC2(F)F.CC(C)(C)c1nc2n(n1)[C@@H](c1ccccc1)C[C@@H]2F.CC(C)(C)c1nc2n(n1)[C@@H](c1ccccc1F)CC2.CC(C)(C)c1nc2n(n1)[C@H](c1ccccc1)C[C@@H]2F.CC(C)(C)c1nc2n(n1)[C@H](c1ccccc1)C[C@H]2F
• InChI: InChI=1S/C17H21FN2.C17H22N2.C16H20FN3.C16H21N3.2C15H17F2N3.6C15H18FN3.C15H19N3/c1-17(2,3)16-11-15-13(8-6-10-20(15)19-16)12-7-4-5-9-14(12)18;1-17(2,3)16-12-15-14(10-7-11-19(15)18-16)13-8-5-4-6-9-13;1-16(2,3)15-18-14-12(8-6-10-20(14)19-15)11-7-4-5-9-13(11)17;1-16(2,3)15-17-14-13(10-7-11-19(14)18-15)12-8-5-4-6-9-12;2*1-14(2,3)12-18-13-15(16,17)9-11(20(13)19-12)10-7-5-4-6-8-10;1-15(2,3)14-17-13-11(8-9-19(13)18-14)10-6-4-5-7-12(10)16;2*1-15(2,3)14-17-13-9-8-12(19(13)18-14)10-6-4-5-7-11(10)16;3*1-15(2,3)14-17-13-11(16)9-12(19(13)18-14)10-7-5-4-6-8-10;1-15(2,3)14-16-13-12(9-10-18(13)17-14)11-7-5-4-6-8-11/h4-5,7,9,11,13H,6,8,10H2,1-3H3;4-6,8-9,12,14H,7,10-11H2,1-3H3;4-5,7,9,12H,6,8,10H2,1-3H3;4-6,8-9,13H,7,10-11H2,1-3H3;2*4-8,11H,9H2,1-3H3;4-7,11H,8-9H2,1-3H3;2*4-7,12H,8-9H2,1-3H3;3*4-8,11-12H,9H2,1-3H3;4-8,12H,9-10H2,1-3H3/t;;;;11-;;;12-;;2*11-,12+;11-,12-;/m....1..1.100./s1
• InChIKey: GCNARIQEODDDHI-VVOHYUAASA-N
• XLogP: 46.41
• TPSA: 373.45 Ų
• H-Bond Acceptors: 37
• Rotatable Bonds: 13
• Heavy Atoms: 250
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3407.41
LogP ≤ 5	46.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine?

The IUPAC name of 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine (CID 158214799) is 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine.

What is the SMILES notation for 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine?

The canonical SMILES for 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine is CC(C)(C)c1cc2n(n1)CCCC2c1ccccc1.CC(C)(C)c1cc2n(n1)CCCC2c1ccccc1F.CC(C)(C)c1nc2n(n1)C(c1ccccc1)CC2(F)F.CC(C)(C)c1nc2n(n1)C(c1ccccc1F)CC2.CC(C)(C)c1nc2n(n1)CCC2c1ccccc1.CC(C)(C)c1nc2n(n1)CCC2c1ccccc1F.CC(C)(C)c1nc2n(n1)CCCC2c1ccccc1.CC(C)(C)c1nc2n(n1)CCCC2c1ccccc1F.CC(C)(C)c1nc2n(n1)[C@@H](c1ccccc1)CC2(F)F.CC(C)(C)c1nc2n(n1)[C@@H](c1ccccc1)C[C@@H]2F.CC(C)(C)c1nc2n(n1)[C@@H](c1ccccc1F)CC2.CC(C)(C)c1nc2n(n1)[C@H](c1ccccc1)C[C@@H]2F.CC(C)(C)c1nc2n(n1)[C@H](c1ccccc1)C[C@H]2F.

What is the InChIKey of 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine?

The InChIKey is GCNARIQEODDDHI-VVOHYUAASA-N. The full InChI is InChI=1S/C17H21FN2.C17H22N2.C16H20FN3.C16H21N3.2C15H17F2N3.6C15H18FN3.C15H19N3/c1-17(2,3)16-11-15-13(8-6-10-20(15)19-16)12-7-4-5-9-14(12)18;1-17(2,3)16-12-15-14(10-7-11-19(15)18-16)13-8-5-4-6-9-13;1-16(2,3)15-18-14-12(8-6-10-20(14)19-15)11-7-4-5-9-13(11)17;1-16(2,3)15-17-14-13(10-7-11-19(14)18-15)12-8-5-4-6-9-12;2*1-14(2,3)12-18-13-15(16,17)9-11(20(13)19-12)10-7-5-4-6-8-10;1-15(2,3)14-17-13-11(8-9-19(13)18-14)10-6-4-5-7-12(10)16;2*1-15(2,3)14-17-13-9-8-12(19(13)18-14)10-6-4-5-7-11(10)16;3*1-15(2,3)14-17-13-11(16)9-12(19(13)18-14)10-7-5-4-6-8-10;1-15(2,3)14-16-13-12(9-10-18(13)17-14)11-7-5-4-6-8-11/h4-5,7,9,11,13H,6,8,10H2,1-3H3;4-6,8-9,12,14H,7,10-11H2,1-3H3;4-5,7,9,12H,6,8,10H2,1-3H3;4-6,8-9,13H,7,10-11H2,1-3H3;2*4-8,11H,9H2,1-3H3;4-7,11H,8-9H2,1-3H3;2*4-7,12H,8-9H2,1-3H3;3*4-8,11-12H,9H2,1-3H3;4-8,12H,9-10H2,1-3H3/t;;;;11-;;;12-;;2*11-,12+;11-,12-;/m....1..1.100./s1.

What are the key properties of 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine?

2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 3407.41 g/mol, XLogP of 46.41, 13 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-7,7-difluoro-5-phenyl-5,6-dihydropyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-7-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R)-2-tert-butyl-5-(2-fluorophenyl)-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5R,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7R)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;(5S,7S)-2-tert-butyl-7-fluoro-5-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-(2-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-(2-fluorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine;2-tert-butyl-7-phenyl-6,7-dihydro-5H-pyrrolo[1,2-b][1,2,4]triazole;2-tert-butyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;2-tert-butyl-8-phenyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 158214799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).