8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one

C173H221N39O21S — CID 157378053

About 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one

8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one (PubChem CID 157378053) has the molecular formula C173H221N39O21S and a molecular weight of 3214.99 g/mol. Its IUPAC name is 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one.

Molecular Properties

• Compound Name: 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one
• PubChem CID: 157378053
• Molecular Formula: C173H221N39O21S
• Molecular Weight: 3214.99 g/mol
• Exact Mass: 3212.71
• IUPAC Name: 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one
• SMILES: C=C1CCC(N2CCC3(CC4CCC(C3)N4CC(O)c3ccc(-n4cnnn4)cn3)C2=O)=C1C.C=C1CCC(N2CCC3(CC4CCC(C3)N4CC(O)c3ccc(-n4cnnn4)nc3C)C2=O)=C1C.C=C1CCC(N2CCC3(CC4CCC(C3)N4C[C@H](O)c3ccc4c(c3C)COC4=O)C2=O)=C1C.C=C1CCC(N2CCC3(CCCN(CC(O)c4ccc(-n5cnnn5)nc4C)CC3)C2=O)=C1C.C=S1(=O)C=C(N2CCC3(CCN(CC(O)c4ccc(-n5cnnn5)nc4C)CC3)C2=O)CC1.CC1=C(N2CCOC3(CCN(C[C@H](O)c4ccc(-n5cnnn5)nc4)CC3)C2)CCC1=O.CC1=C(N2CCOC3(CCN(C[C@H](O)c4ccc5c(c4C)COC5=O)CC3)C2)CCC1=O
• InChI: InChI=1S/C28H34N2O4.C26H33N7O2.C25H31N7O2.C25H33N7O2.C25H32N2O5.C22H29N7O3S.C22H29N7O3/c1-16-4-9-24(17(16)2)29-11-10-28(27(29)33)12-19-5-6-20(13-28)30(19)14-25(31)21-7-8-22-23(18(21)3)15-34-26(22)32;1-16-4-8-22(17(16)2)31-11-10-26(25(31)35)12-19-5-6-20(13-26)32(19)14-23(34)21-7-9-24(28-18(21)3)33-15-27-29-30-33;1-16-3-8-22(17(16)2)30-10-9-25(24(30)34)11-18-4-5-19(12-25)31(18)14-23(33)21-7-6-20(13-26-21)32-15-27-28-29-32;1-17-5-7-21(18(17)2)31-14-11-25(24(31)34)9-4-12-30(13-10-25)15-22(33)20-6-8-23(27-19(20)3)32-16-26-28-29-32;1-16-18(3-4-19-20(16)14-31-24(19)30)23(29)13-26-9-7-25(8-10-26)15-27(11-12-32-25)21-5-6-22(28)17(21)2;1-16-18(3-4-20(24-16)29-15-23-25-26-29)19(30)13-27-9-6-22(7-10-27)8-11-28(21(22)31)17-5-12-33(2,32)14-17;1-16-18(3-4-19(16)30)28-10-11-32-22(14-28)6-8-27(9-7-22)13-20(31)17-2-5-21(23-12-17)29-15-24-25-26-29/h7-8,19-20,25,31H,1,4-6,9-15H2,2-3H3;7,9,15,19-20,23,34H,1,4-6,8,10-14H2,2-3H3;6-7,13,15,18-19,23,33H,1,3-5,8-12,14H2,2H3;6,8,16,22,33H,1,4-5,7,9-15H2,2-3H3;3-4,23,29H,5-15H2,1-2H3;3-4,14-15,19,30H,2,5-13H2,1H3;2,5,12,15,20,31H,3-4,6-11,13-14H2,1H3/t19?,20?,25-,28?;;;;23-;;20-/m0...0.0/s1
• InChIKey: BKNVURKLTYEOKX-IAKRTOMPSA-N
• XLogP: 16.40
• TPSA: 677.04 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 55
• Rotatable Bonds: 33
• Heavy Atoms: 234
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3214.99
LogP ≤ 5	16.40
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	55

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one?

The IUPAC name of 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one (CID 157378053) is 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one.

What is the SMILES notation for 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one?

The canonical SMILES for 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one is C=C1CCC(N2CCC3(CC4CCC(C3)N4CC(O)c3ccc(-n4cnnn4)cn3)C2=O)=C1C.C=C1CCC(N2CCC3(CC4CCC(C3)N4CC(O)c3ccc(-n4cnnn4)nc3C)C2=O)=C1C.C=C1CCC(N2CCC3(CC4CCC(C3)N4C[C@H](O)c3ccc4c(c3C)COC4=O)C2=O)=C1C.C=C1CCC(N2CCC3(CCCN(CC(O)c4ccc(-n5cnnn5)nc4C)CC3)C2=O)=C1C.C=S1(=O)C=C(N2CCC3(CCN(CC(O)c4ccc(-n5cnnn5)nc4C)CC3)C2=O)CC1.CC1=C(N2CCOC3(CCN(C[C@H](O)c4ccc(-n5cnnn5)nc4)CC3)C2)CCC1=O.CC1=C(N2CCOC3(CCN(C[C@H](O)c4ccc5c(c4C)COC5=O)CC3)C2)CCC1=O.

What is the InChIKey of 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one?

The InChIKey is BKNVURKLTYEOKX-IAKRTOMPSA-N. The full InChI is InChI=1S/C28H34N2O4.C26H33N7O2.C25H31N7O2.C25H33N7O2.C25H32N2O5.C22H29N7O3S.C22H29N7O3/c1-16-4-9-24(17(16)2)29-11-10-28(27(29)33)12-19-5-6-20(13-28)30(19)14-25(31)21-7-8-22-23(18(21)3)15-34-26(22)32;1-16-4-8-22(17(16)2)31-11-10-26(25(31)35)12-19-5-6-20(13-26)32(19)14-23(34)21-7-9-24(28-18(21)3)33-15-27-29-30-33;1-16-3-8-22(17(16)2)30-10-9-25(24(30)34)11-18-4-5-19(12-25)31(18)14-23(33)21-7-6-20(13-26-21)32-15-27-28-29-32;1-17-5-7-21(18(17)2)31-14-11-25(24(31)34)9-4-12-30(13-10-25)15-22(33)20-6-8-23(27-19(20)3)32-16-26-28-29-32;1-16-18(3-4-19-20(16)14-31-24(19)30)23(29)13-26-9-7-25(8-10-26)15-27(11-12-32-25)21-5-6-22(28)17(21)2;1-16-18(3-4-20(24-16)29-15-23-25-26-29)19(30)13-27-9-6-22(7-10-27)8-11-28(21(22)31)17-5-12-33(2,32)14-17;1-16-18(3-4-19(16)30)28-10-11-32-22(14-28)6-8-27(9-7-22)13-20(31)17-2-5-21(23-12-17)29-15-24-25-26-29/h7-8,19-20,25,31H,1,4-6,9-15H2,2-3H3;7,9,15,19-20,23,34H,1,4-6,8,10-14H2,2-3H3;6-7,13,15,18-19,23,33H,1,3-5,8-12,14H2,2H3;6,8,16,22,33H,1,4-5,7,9-15H2,2-3H3;3-4,23,29H,5-15H2,1-2H3;3-4,14-15,19,30H,2,5-13H2,1H3;2,5,12,15,20,31H,3-4,6-11,13-14H2,1H3/t19?,20?,25-,28?;;;;23-;;20-/m0...0.0/s1.

What are the key properties of 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one?

8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one has a molecular weight of 3214.99 g/mol, XLogP of 16.40, 33 rotatable bonds, 7 hydrogen bond donors, and 55 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[(2R)-2-hydroxy-2-(4-methyl-1-oxo-3H-2-benzofuran-5-yl)ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;5-[(1R)-1-hydroxy-2-[4-(2-methyl-3-oxocyclopenten-1-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]ethyl]-4-methyl-3H-2-benzofuran-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(1-methylidene-1-oxo-2,3-dihydrothiophen-4-yl)-2,8-diazaspiro[4.5]decan-1-one;9-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-2-(2-methyl-3-methylidenecyclopenten-1-yl)-2,9-diazaspiro[4.6]undecan-1-one;8-[2-hydroxy-2-[2-methyl-6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;8-[2-hydroxy-2-[5-(tetrazol-1-yl)-2-pyridinyl]ethyl]-1'-(2-methyl-3-methylidenecyclopenten-1-yl)spiro[8-azabicyclo[3.2.1]octane-3,3'-pyrrolidine]-2'-one;3-[9-[(2R)-2-hydroxy-2-[6-(tetrazol-1-yl)-3-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-2-methylcyclopent-2-en-1-one is sourced from PubChem (CID 157378053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).