About tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate
tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate (PubChem CID 161246462) has the molecular formula C49H56F2N4O4
and a molecular weight of 803.01 g/mol. Its IUPAC name is tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate.
Analyze tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate with MolForge
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Frequently Asked Questions
What is the IUPAC name of tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate?
The IUPAC name of tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate (CID 161246462) is tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate.
What is the SMILES notation for tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate?
The canonical SMILES for tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate is Cc1ccc2c(c1)C(F)(F)c1cc(C3=CN=C(C4CC5(CC5)CN4C(=O)OC(C)(C)C)C3)ccc1-2.Cc1ccc2c(c1)CC([C@@H]1[C@H]3CC[C@H](C3)N1C(=O)OC(C)(C)C)=N2.
What is the InChIKey of tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate?
The InChIKey is VARWRWHAVFGMFC-LEQLOCCTSA-N. The full InChI is InChI=1S/C29H30F2N2O2.C20H26N2O2/c1-17-5-7-20-21-8-6-18(12-23(21)29(30,31)22(20)11-17)19-13-24(32-15-19)25-14-28(9-10-28)16-33(25)26(34)35-27(2,3)4;1-12-5-8-16-14(9-12)11-17(21-16)18-13-6-7-15(10-13)22(18)19(23)24-20(2,3)4/h5-8,11-12,15,25H,9-10,13-14,16H2,1-4H3;5,8-9,13,15,18H,6-7,10-11H2,1-4H3/t;13-,15+,18-/m.0/s1.
What are the key properties of tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate?
tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate has a molecular weight of 803.01 g/mol, XLogP of 11.50, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 6-[4-(9,9-difluoro-7-methylfluoren-2-yl)-3H-pyrrol-2-yl]-5-azaspiro[2.4]heptane-5-carboxylate;tert-butyl (1R,3S,4S)-3-(5-methyl-3H-indol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate is sourced from PubChem (CID 161246462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).