5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine

C152H193F5N10O11S3 — CID 160921943

IUPAC5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine
SMILESCC(C)(C)OCc1ccc(CN2CCC3(C=Cc4ccccc43)CC2)s1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2cc(F)ncc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccc(F)cc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccccc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccccc23)s1.CC(C)(C)Oc1nnc(C(F)(F)F)c2ccccc12.CN1CC2(CCN(Cc3ccc(COC(C)(C)C)s3)CC2)c2ccccc21
InChIInChI=1S/C24H30FNO2.C24H31NO2.C23H29FN2O2.C23H32N2OS.C23H29NOS.C22H29NO2S.C13H13F3N2O/c1-23(2,3)27-16-19-6-4-18(5-7-19)15-26-12-10-24(11-13-26)22-14-21(25)9-8-20(22)17-28-24;1-23(2,3)26-17-20-10-8-19(9-11-20)16-25-14-12-24(13-15-25)22-7-5-4-6-21(22)18-27-24;1-22(2,3)27-15-18-6-4-17(5-7-18)14-26-10-8-23(9-11-26)20-13-25-21(24)12-19(20)16-28-23;1-22(2,3)26-16-19-10-9-18(27-19)15-25-13-11-23(12-14-25)17-24(4)21-8-6-5-7-20(21)23;1-22(2,3)25-17-20-9-8-19(26-20)16-24-14-12-23(13-15-24)11-10-18-6-4-5-7-21(18)23;1-21(2,3)24-16-19-9-8-18(26-19)14-23-12-10-22(11-13-23)20-7-5-4-6-17(20)15-25-22;1-12(2,3)19-11-9-7-5-4-6-8(9)10(17-18-11)13(14,15)16/h4-9,14H,10-13,15-17H2,1-3H3;4-11H,12-18H2,1-3H3;4-7,12-13H,8-11,14-16H2,1-3H3;5-10H,11-17H2,1-4H3;4-11H,12-17H2,1-3H3;4-9H,10-16H2,1-3H3;4-7H,1-3H3
InChIKeySSDMCLCWSLNFSI-UHFFFAOYSA-N
MW2527.47 g/mol
LogP34.32
Rot. Bonds25

About 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine

5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine (PubChem CID 160921943) has the molecular formula C152H193F5N10O11S3 and a molecular weight of 2527.47 g/mol. Its IUPAC name is 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine.

Molecular Properties

Compound Name5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine
PubChem CID160921943
Molecular FormulaC152H193F5N10O11S3
Molecular Weight2527.47 g/mol
Exact Mass2525.39
IUPAC Name5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine
SMILESCC(C)(C)OCc1ccc(CN2CCC3(C=Cc4ccccc43)CC2)s1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2cc(F)ncc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccc(F)cc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccccc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccccc23)s1.CC(C)(C)Oc1nnc(C(F)(F)F)c2ccccc12.CN1CC2(CCN(Cc3ccc(COC(C)(C)C)s3)CC2)c2ccccc21
InChIInChI=1S/C24H30FNO2.C24H31NO2.C23H29FN2O2.C23H32N2OS.C23H29NOS.C22H29NO2S.C13H13F3N2O/c1-23(2,3)27-16-19-6-4-18(5-7-19)15-26-12-10-24(11-13-26)22-14-21(25)9-8-20(22)17-28-24;1-23(2,3)26-17-20-10-8-19(9-11-20)16-25-14-12-24(13-15-25)22-7-5-4-6-21(22)18-27-24;1-22(2,3)27-15-18-6-4-17(5-7-18)14-26-10-8-23(9-11-26)20-13-25-21(24)12-19(20)16-28-23;1-22(2,3)26-16-19-10-9-18(27-19)15-25-13-11-23(12-14-25)17-24(4)21-8-6-5-7-20(21)23;1-22(2,3)25-17-20-9-8-19(26-20)16-24-14-12-23(13-15-24)11-10-18-6-4-5-7-21(18)23;1-21(2,3)24-16-19-9-8-18(26-19)14-23-12-10-22(11-13-23)20-7-5-4-6-17(20)15-25-22;1-12(2,3)19-11-9-7-5-4-6-8(9)10(17-18-11)13(14,15)16/h4-9,14H,10-13,15-17H2,1-3H3;4-11H,12-18H2,1-3H3;4-7,12-13H,8-11,14-16H2,1-3H3;5-10H,11-17H2,1-4H3;4-11H,12-17H2,1-3H3;4-9H,10-16H2,1-3H3;4-7H,1-3H3
InChIKeySSDMCLCWSLNFSI-UHFFFAOYSA-N
XLogP34.32
TPSA162.88 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds25
Heavy Atoms181
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002527.47
LogP ≤ 534.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine with MolForge

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Related Compounds

5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];4-[(2-methylpropan-2-yl)oxy]-2-(2,2,2-trifluoroethyl)-3,4-dihydroisoquinolin-1-one;1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine
CID 157374708
5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1,2-dihydroindene-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];4-[(2-methylpropan-2-yl)oxy]-2-(2,2,2-trifluoroethyl)-3,4-dihydroisoquinolin-1-one;1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine
CID 160681105
2-Tert-butyl-1-benzothiophene;4-tert-butyl-1,2-dimethylbenzene;1-tert-butyl-4-fluoronaphthalene;2-tert-butyl-1-fluoronaphthalene;7-tert-butyl-3-methoxyisoquinoline;6-tert-butyl-1-methoxynaphthalene;6-tert-butyl-2-methoxyquinoline;6-tert-butyl-1-methylindole;2-tert-butyl-1-methylnaphthalene;1-tert-butylnaphthalene;6-tert-butyl-1-phenoxynaphthalene;1-tert-butyl-2-phenylbenzene;4-tert-butyl-1-phenylpyrazole;2-tert-butylquinoline;3-tert-butylquinoline;6-tert-butylquinoline;6-tert-butyl-1,2,3,4-tetrahydronaphthalene;1-tert-butyl-4-(trifluoromethoxy)benzene
CID 161369268

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine?
The IUPAC name of 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine (CID 160921943) is 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine.
What is the SMILES notation for 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine?
The canonical SMILES for 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine is CC(C)(C)OCc1ccc(CN2CCC3(C=Cc4ccccc43)CC2)s1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2cc(F)ncc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccc(F)cc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccccc23)cc1.CC(C)(C)OCc1ccc(CN2CCC3(CC2)OCc2ccccc23)s1.CC(C)(C)Oc1nnc(C(F)(F)F)c2ccccc12.CN1CC2(CCN(Cc3ccc(COC(C)(C)C)s3)CC2)c2ccccc21.
What is the InChIKey of 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine?
The InChIKey is SSDMCLCWSLNFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30FNO2.C24H31NO2.C23H29FN2O2.C23H32N2OS.C23H29NOS.C22H29NO2S.C13H13F3N2O/c1-23(2,3)27-16-19-6-4-18(5-7-19)15-26-12-10-24(11-13-26)22-14-21(25)9-8-20(22)17-28-24;1-23(2,3)26-17-20-10-8-19(9-11-20)16-25-14-12-24(13-15-25)22-7-5-4-6-21(22)18-27-24;1-22(2,3)27-15-18-6-4-17(5-7-18)14-26-10-8-23(9-11-26)20-13-25-21(24)12-19(20)16-28-23;1-22(2,3)26-16-19-10-9-18(27-19)15-25-13-11-23(12-14-25)17-24(4)21-8-6-5-7-20(21)23;1-22(2,3)25-17-20-9-8-19(26-20)16-24-14-12-23(13-15-24)11-10-18-6-4-5-7-21(18)23;1-21(2,3)24-16-19-9-8-18(26-19)14-23-12-10-22(11-13-23)20-7-5-4-6-17(20)15-25-22;1-12(2,3)19-11-9-7-5-4-6-8(9)10(17-18-11)13(14,15)16/h4-9,14H,10-13,15-17H2,1-3H3;4-11H,12-18H2,1-3H3;4-7,12-13H,8-11,14-16H2,1-3H3;5-10H,11-17H2,1-4H3;4-11H,12-17H2,1-3H3;4-9H,10-16H2,1-3H3;4-7H,1-3H3.
What are the key properties of 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine?
5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine has a molecular weight of 2527.47 g/mol, XLogP of 34.32, 25 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];6-fluoro-1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine];1-methyl-1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[2H-indole-3,4'-piperidine];1'-[[4-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[1H-2-benzofuran-3,4'-piperidine];1'-[[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methyl]spiro[indene-1,4'-piperidine];1-[(2-methylpropan-2-yl)oxy]-4-(trifluoromethyl)phthalazine is sourced from PubChem (CID 160921943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).