bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one

C177H199Cl2N17O16 — CID 161160570

IUPACbis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one
SMILESCc1cc(Cl)cc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)c1.Cc1ccc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)cc1.Cc1ccc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)cc1.O=c1[nH]ccc2cc(OCC3CCN(C4CCCCC4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4Cl)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4cccnc4)CC3)ccc12
InChIInChI=1S/C23H25ClN2O2.2C23H26N2O2.C22H23ClN2O2.2C22H24N2O2.C21H23N3O2.C21H28N2O2/c1-16-10-18(12-20(24)11-16)14-26-8-5-17(6-9-26)15-28-21-2-3-22-19(13-21)4-7-25-23(22)27;2*1-17-2-4-18(5-3-17)15-25-12-9-19(10-13-25)16-27-21-6-7-22-20(14-21)8-11-24-23(22)26;23-21-4-2-1-3-18(21)14-25-11-8-16(9-12-25)15-27-19-5-6-20-17(13-19)7-10-24-22(20)26;2*25-22-21-7-6-20(14-19(21)8-11-23-22)26-16-18-9-12-24(13-10-18)15-17-4-2-1-3-5-17;25-21-20-4-3-19(12-18(20)5-9-23-21)26-15-16-6-10-24(11-7-16)14-17-2-1-8-22-13-17;24-21-20-7-6-19(14-17(20)8-11-22-21)25-15-16-9-12-23(13-10-16)18-4-2-1-3-5-18/h2-4,7,10-13,17H,5-6,8-9,14-15H2,1H3,(H,25,27);2*2-8,11,14,19H,9-10,12-13,15-16H2,1H3,(H,24,26);1-7,10,13,16H,8-9,11-12,14-15H2,(H,24,26);2*1-8,11,14,18H,9-10,12-13,15-16H2,(H,23,25);1-5,8-9,12-13,16H,6-7,10-11,14-15H2,(H,23,25);6-8,11,14,16,18H,1-5,9-10,12-13,15H2,(H,22,24)
InChIKeyUPWBYZZOPHBPDS-UHFFFAOYSA-N
MW2891.55 g/mol
LogP32.31
Rot. Bonds39

About bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one

bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one (PubChem CID 161160570) has the molecular formula C177H199Cl2N17O16 and a molecular weight of 2891.55 g/mol. Its IUPAC name is bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one.

Molecular Properties

Compound Namebis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one
PubChem CID161160570
Molecular FormulaC177H199Cl2N17O16
Molecular Weight2891.55 g/mol
Exact Mass2888.47
IUPAC Namebis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one
SMILESCc1cc(Cl)cc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)c1.Cc1ccc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)cc1.Cc1ccc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)cc1.O=c1[nH]ccc2cc(OCC3CCN(C4CCCCC4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4Cl)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4cccnc4)CC3)ccc12
InChIInChI=1S/C23H25ClN2O2.2C23H26N2O2.C22H23ClN2O2.2C22H24N2O2.C21H23N3O2.C21H28N2O2/c1-16-10-18(12-20(24)11-16)14-26-8-5-17(6-9-26)15-28-21-2-3-22-19(13-21)4-7-25-23(22)27;2*1-17-2-4-18(5-3-17)15-25-12-9-19(10-13-25)16-27-21-6-7-22-20(14-21)8-11-24-23(22)26;23-21-4-2-1-3-18(21)14-25-11-8-16(9-12-25)15-27-19-5-6-20-17(13-19)7-10-24-22(20)26;2*25-22-21-7-6-20(14-19(21)8-11-23-22)26-16-18-9-12-24(13-10-18)15-17-4-2-1-3-5-17;25-21-20-4-3-19(12-18(20)5-9-23-21)26-15-16-6-10-24(11-7-16)14-17-2-1-8-22-13-17;24-21-20-7-6-19(14-17(20)8-11-22-21)25-15-16-9-12-23(13-10-16)18-4-2-1-3-5-18/h2-4,7,10-13,17H,5-6,8-9,14-15H2,1H3,(H,25,27);2*2-8,11,14,19H,9-10,12-13,15-16H2,1H3,(H,24,26);1-7,10,13,16H,8-9,11-12,14-15H2,(H,24,26);2*1-8,11,14,18H,9-10,12-13,15-16H2,(H,23,25);1-5,8-9,12-13,16H,6-7,10-11,14-15H2,(H,23,25);6-8,11,14,16,18H,1-5,9-10,12-13,15H2,(H,22,24)
InChIKeyUPWBYZZOPHBPDS-UHFFFAOYSA-N
XLogP32.31
TPSA375.53 Ų
H-Bond Donors8
H-Bond Acceptors25
Rotatable Bonds39
Heavy Atoms212
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002891.55
LogP ≤ 532.31
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1025

Analyze bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one with MolForge

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Related Compounds

bis(6-(1-benzylpiperidin-4-yl)oxy-2H-isoquinolin-1-one);6-[1-[(2-chloro-4-methylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;6-[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;6-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;6-[1-[[4-(1,1-difluoroethyl)phenyl]methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;6-[1-[(3-methylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;bis(6-[1-[(4-methylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one);6-[1-[(4-methylsulfonylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;6-[1-(pyridin-3-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one
CID 157733810
6-[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]oxy-4-ethyl-5-fluoro-2H-isoquinolin-1-one;6-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]oxy-4-ethyl-5-fluoro-2H-isoquinolin-1-one;6-[1-[(3-chlorophenyl)methyl]piperidin-4-yl]oxy-4-ethyl-5-fluoro-2H-isoquinolin-1-one;6-[1-(cyclohexylmethyl)piperidin-4-yl]oxy-4-ethyl-5-fluoro-2H-isoquinolin-1-one;6-[1-(3,3-difluorobutyl)piperidin-4-yl]oxy-4-ethyl-5-fluoro-2H-isoquinolin-1-one;4-ethyl-5-fluoro-6-[1-[(4-methylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;4-ethyl-5-fluoro-6-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one;4-ethyl-5-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one;4-ethyl-5-fluoro-6-[1-(pyridin-3-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one
CID 158994999
bis(6-(1-benzylpiperidin-4-yl)oxy-4-ethyl-2H-isoquinolin-1-one);6-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]oxy-4-ethyl-2H-isoquinolin-1-one;6-[1-[(3-chlorophenyl)methyl]piperidin-4-yl]oxy-4-ethyl-2H-isoquinolin-1-one;6-[1-[[4-(1,1-difluoroethyl)phenyl]methyl]piperidin-4-yl]oxy-4-ethyl-2H-isoquinolin-1-one;bis(4-ethyl-6-[1-[(4-methylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one);4-ethyl-6-[1-[(4-methylsulfonylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one;4-ethyl-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one
CID 159559429
bis(6-(1-benzylpiperidin-4-yl)oxy-7-methyl-2H-isoquinolin-1-one);6-[1-[(2-chloro-4-methylphenyl)methyl]piperidin-4-yl]oxy-7-methyl-2H-isoquinolin-1-one;6-[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]oxy-7-methyl-2H-isoquinolin-1-one;6-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]oxy-7-methyl-2H-isoquinolin-1-one;6-[1-[(3-chlorophenyl)methyl]piperidin-4-yl]oxy-7-methyl-2H-isoquinolin-1-one;6-(1-cyclohexylpiperidin-4-yl)oxy-7-methyl-2H-isoquinolin-1-one;6-[1-[[4-(1,1-difluoroethyl)phenyl]methyl]piperidin-4-yl]oxy-7-methyl-2H-isoquinolin-1-one;bis(7-methyl-6-[1-[(4-methylphenyl)methyl]piperidin-4-yl]oxy-2H-isoquinolin-1-one);7-methyl-6-[1-(pyridin-3-ylmethyl)piperidin-4-yl]oxy-2H-isoquinolin-1-one
CID 159627575
CID 160481940
CID 160481940
1-chloro-3-fluoro-2-propan-2-ylbenzene;2-chloro-4-methyl-1-propan-2-ylbenzene;deuterium monohydride;N,N-dimethyl-3-propan-2-ylbenzamide;1,2-dimethyl-4-propan-2-ylbenzene;N-ethyl-3-propan-2-ylbenzamide;1-(1-fluoroethoxy)-3-propan-2-ylbenzene;methane;1-methoxy-3-propan-2-ylbenzene;bis(1-methyl-3-propan-2-ylbenzene);3-methyl-5-propan-2-ylpyridine;1-propan-2-yl-3-(trifluoromethoxy)benzene
CID 161158255
[4-[[4-[4-[3-[5-[[(1-Benzoylpiperidin-4-yl)amino]methyl]-6-methoxy-2-pyridinyl]-2-chlorophenyl]-3-chloro-2-pyridinyl]-2-methoxyphenyl]methylamino]piperidin-1-yl]-phenylmethanone
CID 170697116
[6-[[5-[(2-Chlorophenyl)methoxy]-2-pyridinyl]oxy]naphthalen-2-yl]-[4-[[4-[2-(4-propan-2-ylphenoxy)ethyl]phenyl]methyl]piperazin-1-yl]methanone;hydrochloride
CID 67327341
3-chloro-N-[4-[4-(1-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)piperidin-1-yl]butyl]-2-pyridin-3-ylbenzamide
CID 69613215
2-[4-[5-[[5-(4-chlorobenzoyl)-2-pyridinyl]oxy]pentyl]piperazin-1-yl]-3-[4-[5-[4-(4-chlorobenzoyl)-2,3,6-trimethylphenoxy]pentyl]piperazin-1-yl]-N,N'-di(propan-2-yl)butanediamide
CID 87721837
4-(4-chlorophenyl)-3-[[4-(2-cyclohexylphenyl)phenoxy]methyl]-N-(pyridin-4-ylmethyl)benzamide
CID 141116079
1-chloro-3-fluoro-2-propan-2-ylbenzene;2-chloro-4-methyl-1-propan-2-ylbenzene;N,N-dimethyl-3-propan-2-ylbenzamide;1,2-dimethyl-4-propan-2-ylbenzene;N-ethyl-3-propan-2-ylbenzamide;1-(1-fluoroethoxy)-3-propan-2-ylbenzene;1-methoxy-3-propan-2-ylbenzene;tris(1-methyl-3-propan-2-ylbenzene);3-methyl-5-propan-2-ylpyridine
CID 157167208

Frequently Asked Questions

What is the IUPAC name of bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one?
The IUPAC name of bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one (CID 161160570) is bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one.
What is the SMILES notation for bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one?
The canonical SMILES for bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one is Cc1cc(Cl)cc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)c1.Cc1ccc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)cc1.Cc1ccc(CN2CCC(COc3ccc4c(=O)[nH]ccc4c3)CC2)cc1.O=c1[nH]ccc2cc(OCC3CCN(C4CCCCC4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4ccccc4Cl)CC3)ccc12.O=c1[nH]ccc2cc(OCC3CCN(Cc4cccnc4)CC3)ccc12.
What is the InChIKey of bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one?
The InChIKey is UPWBYZZOPHBPDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25ClN2O2.2C23H26N2O2.C22H23ClN2O2.2C22H24N2O2.C21H23N3O2.C21H28N2O2/c1-16-10-18(12-20(24)11-16)14-26-8-5-17(6-9-26)15-28-21-2-3-22-19(13-21)4-7-25-23(22)27;2*1-17-2-4-18(5-3-17)15-25-12-9-19(10-13-25)16-27-21-6-7-22-20(14-21)8-11-24-23(22)26;23-21-4-2-1-3-18(21)14-25-11-8-16(9-12-25)15-27-19-5-6-20-17(13-19)7-10-24-22(20)26;2*25-22-21-7-6-20(14-19(21)8-11-23-22)26-16-18-9-12-24(13-10-18)15-17-4-2-1-3-5-17;25-21-20-4-3-19(12-18(20)5-9-23-21)26-15-16-6-10-24(11-7-16)14-17-2-1-8-22-13-17;24-21-20-7-6-19(14-17(20)8-11-22-21)25-15-16-9-12-23(13-10-16)18-4-2-1-3-5-18/h2-4,7,10-13,17H,5-6,8-9,14-15H2,1H3,(H,25,27);2*2-8,11,14,19H,9-10,12-13,15-16H2,1H3,(H,24,26);1-7,10,13,16H,8-9,11-12,14-15H2,(H,24,26);2*1-8,11,14,18H,9-10,12-13,15-16H2,(H,23,25);1-5,8-9,12-13,16H,6-7,10-11,14-15H2,(H,23,25);6-8,11,14,16,18H,1-5,9-10,12-13,15H2,(H,22,24).
What are the key properties of bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one?
bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one has a molecular weight of 2891.55 g/mol, XLogP of 32.31, 39 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6-[(1-benzylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one);6-[[1-[(3-chloro-5-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one;6-[(1-cyclohexylpiperidin-4-yl)methoxy]-2H-isoquinolin-1-one;bis(6-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methoxy]-2H-isoquinolin-1-one);6-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methoxy]-2H-isoquinolin-1-one is sourced from PubChem (CID 161160570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).