1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline

C227H330ClF2N15OS3 — CID 161410386

IUPAC1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline
SMILESC.C.C.C.C.C.C.CC(C)C1(C)CCCN(Cc2cc3ccccc3s2)C1.CC(C)C1CCC(c2ccccc2)N(Cc2c(F)cccc2F)C1.CC(C)C1CCC(c2ccccc2)NC1.CC(C)C1CCCN(Cc2ccnc3ccccc23)C1.CC(C)C1CCCN(Cc2csc3ccccc23)C1.CC(C)[C@@H]1CCCN(Cc2cccc3ccccc23)C1.CC1CC(C(C)C)CN(Cc2cc3ccccc3n2C)C1.CC1CC(C(C)C)CN(Cc2ccc3ccccc3n2)C1.CC1CC(C(C)C)CN(Cc2ccccc2Cl)C1.CC1CC(C(C)C)CN(Cc2csc3ccccc23)C1.CCc1ccc(CN2CCCC(C(C)C)C2)c2ccccc12.COc1ccc2ccccc2c1CN1CCCC(C(C)C)C1
InChIInChI=1S/C21H25F2N.C21H29N.C20H27NO.C19H28N2.C19H26N2.C19H25N.C18H24N2.2C18H25NS.C17H23NS.C16H24ClN.C14H21N.7CH4/c1-15(2)17-11-12-21(16-7-4-3-5-8-16)24(13-17)14-18-19(22)9-6-10-20(18)23;1-4-17-11-12-19(21-10-6-5-9-20(17)21)15-22-13-7-8-18(14-22)16(2)3;1-15(2)17-8-6-12-21(13-17)14-19-18-9-5-4-7-16(18)10-11-20(19)22-3;1-14(2)17-9-15(3)11-21(12-17)13-18-10-16-7-5-6-8-19(16)20(18)4;1-14(2)17-10-15(3)11-21(12-17)13-18-9-8-16-6-4-5-7-19(16)20-18;1-15(2)17-10-6-12-20(13-17)14-18-9-5-8-16-7-3-4-11-19(16)18;1-14(2)15-6-5-11-20(12-15)13-16-9-10-19-18-8-4-3-7-17(16)18;1-14(2)18(3)9-6-10-19(13-18)12-16-11-15-7-4-5-8-17(15)20-16;1-13(2)15-8-14(3)9-19(10-15)11-16-12-20-18-7-5-4-6-17(16)18;1-13(2)14-6-5-9-18(10-14)11-15-12-19-17-8-4-3-7-16(15)17;1-12(2)15-8-13(3)9-18(11-15)10-14-6-4-5-7-16(14)17;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;;;;;;;/h3-10,15,17,21H,11-14H2,1-2H3;5-6,9-12,16,18H,4,7-8,13-15H2,1-3H3;4-5,7,9-11,15,17H,6,8,12-14H2,1-3H3;5-8,10,14-15,17H,9,11-13H2,1-4H3;4-9,14-15,17H,10-13H2,1-3H3;3-5,7-9,11,15,17H,6,10,12-14H2,1-2H3;3-4,7-10,14-15H,5-6,11-13H2,1-2H3;4-5,7-8,11,14H,6,9-10,12-13H2,1-3H3;4-7,12-15H,8-11H2,1-3H3;3-4,7-8,12-14H,5-6,9-11H2,1-2H3;4-7,12-13,15H,8-11H2,1-3H3;3-7,11,13-15H,8-10H2,1-2H3;7*1H4/t;;;;;17-;;;;;;;;;;;;;/m.....1............./s1
InChIKeyVVJSPOXPXTWUJS-YOXDVMOWSA-N
MW3454.89 g/mol
LogP60.25
Rot. Bonds38

About 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline

1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline (PubChem CID 161410386) has the molecular formula C227H330ClF2N15OS3 and a molecular weight of 3454.89 g/mol. Its IUPAC name is 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline.

Molecular Properties

Compound Name1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline
PubChem CID161410386
Molecular FormulaC227H330ClF2N15OS3
Molecular Weight3454.89 g/mol
Exact Mass3451.51
IUPAC Name1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline
SMILESC.C.C.C.C.C.C.CC(C)C1(C)CCCN(Cc2cc3ccccc3s2)C1.CC(C)C1CCC(c2ccccc2)N(Cc2c(F)cccc2F)C1.CC(C)C1CCC(c2ccccc2)NC1.CC(C)C1CCCN(Cc2ccnc3ccccc23)C1.CC(C)C1CCCN(Cc2csc3ccccc23)C1.CC(C)[C@@H]1CCCN(Cc2cccc3ccccc23)C1.CC1CC(C(C)C)CN(Cc2cc3ccccc3n2C)C1.CC1CC(C(C)C)CN(Cc2ccc3ccccc3n2)C1.CC1CC(C(C)C)CN(Cc2ccccc2Cl)C1.CC1CC(C(C)C)CN(Cc2csc3ccccc23)C1.CCc1ccc(CN2CCCC(C(C)C)C2)c2ccccc12.COc1ccc2ccccc2c1CN1CCCC(C(C)C)C1
InChIInChI=1S/C21H25F2N.C21H29N.C20H27NO.C19H28N2.C19H26N2.C19H25N.C18H24N2.2C18H25NS.C17H23NS.C16H24ClN.C14H21N.7CH4/c1-15(2)17-11-12-21(16-7-4-3-5-8-16)24(13-17)14-18-19(22)9-6-10-20(18)23;1-4-17-11-12-19(21-10-6-5-9-20(17)21)15-22-13-7-8-18(14-22)16(2)3;1-15(2)17-8-6-12-21(13-17)14-19-18-9-5-4-7-16(18)10-11-20(19)22-3;1-14(2)17-9-15(3)11-21(12-17)13-18-10-16-7-5-6-8-19(16)20(18)4;1-14(2)17-10-15(3)11-21(12-17)13-18-9-8-16-6-4-5-7-19(16)20-18;1-15(2)17-10-6-12-20(13-17)14-18-9-5-8-16-7-3-4-11-19(16)18;1-14(2)15-6-5-11-20(12-15)13-16-9-10-19-18-8-4-3-7-17(16)18;1-14(2)18(3)9-6-10-19(13-18)12-16-11-15-7-4-5-8-17(15)20-16;1-13(2)15-8-14(3)9-19(10-15)11-16-12-20-18-7-5-4-6-17(16)18;1-13(2)14-6-5-9-18(10-14)11-15-12-19-17-8-4-3-7-16(15)17;1-12(2)15-8-13(3)9-18(11-15)10-14-6-4-5-7-16(14)17;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;;;;;;;/h3-10,15,17,21H,11-14H2,1-2H3;5-6,9-12,16,18H,4,7-8,13-15H2,1-3H3;4-5,7,9-11,15,17H,6,8,12-14H2,1-3H3;5-8,10,14-15,17H,9,11-13H2,1-4H3;4-9,14-15,17H,10-13H2,1-3H3;3-5,7-9,11,15,17H,6,10,12-14H2,1-2H3;3-4,7-10,14-15H,5-6,11-13H2,1-2H3;4-5,7-8,11,14H,6,9-10,12-13H2,1-3H3;4-7,12-15H,8-11H2,1-3H3;3-4,7-8,12-14H,5-6,9-11H2,1-2H3;4-7,12-13,15H,8-11H2,1-3H3;3-7,11,13-15H,8-10H2,1-2H3;7*1H4/t;;;;;17-;;;;;;;;;;;;;/m.....1............./s1
InChIKeyVVJSPOXPXTWUJS-YOXDVMOWSA-N
XLogP60.25
TPSA87.61 Ų
H-Bond Donors1
H-Bond Acceptors19
Rotatable Bonds38
Heavy Atoms249
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003454.89
LogP ≤ 560.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1019

Analyze 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline?
The IUPAC name of 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline (CID 161410386) is 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline.
What is the SMILES notation for 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline?
The canonical SMILES for 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline is C.C.C.C.C.C.C.CC(C)C1(C)CCCN(Cc2cc3ccccc3s2)C1.CC(C)C1CCC(c2ccccc2)N(Cc2c(F)cccc2F)C1.CC(C)C1CCC(c2ccccc2)NC1.CC(C)C1CCCN(Cc2ccnc3ccccc23)C1.CC(C)C1CCCN(Cc2csc3ccccc23)C1.CC(C)[C@@H]1CCCN(Cc2cccc3ccccc23)C1.CC1CC(C(C)C)CN(Cc2cc3ccccc3n2C)C1.CC1CC(C(C)C)CN(Cc2ccc3ccccc3n2)C1.CC1CC(C(C)C)CN(Cc2ccccc2Cl)C1.CC1CC(C(C)C)CN(Cc2csc3ccccc23)C1.CCc1ccc(CN2CCCC(C(C)C)C2)c2ccccc12.COc1ccc2ccccc2c1CN1CCCC(C(C)C)C1.
What is the InChIKey of 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline?
The InChIKey is VVJSPOXPXTWUJS-YOXDVMOWSA-N. The full InChI is InChI=1S/C21H25F2N.C21H29N.C20H27NO.C19H28N2.C19H26N2.C19H25N.C18H24N2.2C18H25NS.C17H23NS.C16H24ClN.C14H21N.7CH4/c1-15(2)17-11-12-21(16-7-4-3-5-8-16)24(13-17)14-18-19(22)9-6-10-20(18)23;1-4-17-11-12-19(21-10-6-5-9-20(17)21)15-22-13-7-8-18(14-22)16(2)3;1-15(2)17-8-6-12-21(13-17)14-19-18-9-5-4-7-16(18)10-11-20(19)22-3;1-14(2)17-9-15(3)11-21(12-17)13-18-10-16-7-5-6-8-19(16)20(18)4;1-14(2)17-10-15(3)11-21(12-17)13-18-9-8-16-6-4-5-7-19(16)20-18;1-15(2)17-10-6-12-20(13-17)14-18-9-5-8-16-7-3-4-11-19(16)18;1-14(2)15-6-5-11-20(12-15)13-16-9-10-19-18-8-4-3-7-17(16)18;1-14(2)18(3)9-6-10-19(13-18)12-16-11-15-7-4-5-8-17(15)20-16;1-13(2)15-8-14(3)9-19(10-15)11-16-12-20-18-7-5-4-6-17(16)18;1-13(2)14-6-5-9-18(10-14)11-15-12-19-17-8-4-3-7-16(15)17;1-12(2)15-8-13(3)9-18(11-15)10-14-6-4-5-7-16(14)17;1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;;;;;;;/h3-10,15,17,21H,11-14H2,1-2H3;5-6,9-12,16,18H,4,7-8,13-15H2,1-3H3;4-5,7,9-11,15,17H,6,8,12-14H2,1-3H3;5-8,10,14-15,17H,9,11-13H2,1-4H3;4-9,14-15,17H,10-13H2,1-3H3;3-5,7-9,11,15,17H,6,10,12-14H2,1-2H3;3-4,7-10,14-15H,5-6,11-13H2,1-2H3;4-5,7-8,11,14H,6,9-10,12-13H2,1-3H3;4-7,12-15H,8-11H2,1-3H3;3-4,7-8,12-14H,5-6,9-11H2,1-2H3;4-7,12-13,15H,8-11H2,1-3H3;3-7,11,13-15H,8-10H2,1-2H3;7*1H4/t;;;;;17-;;;;;;;;;;;;;/m.....1............./s1.
What are the key properties of 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline?
1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline has a molecular weight of 3454.89 g/mol, XLogP of 60.25, 38 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzothiophen-2-ylmethyl)-3-methyl-3-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-methyl-5-propan-2-ylpiperidine;1-(1-benzothiophen-3-ylmethyl)-3-propan-2-ylpiperidine;1-[(2-chlorophenyl)methyl]-3-methyl-5-propan-2-ylpiperidine;1-[(2,6-difluorophenyl)methyl]-2-phenyl-5-propan-2-ylpiperidine;(3S)-1-[(4-ethylnaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;methane;1-[(2-methoxynaphthalen-1-yl)methyl]-3-propan-2-ylpiperidine;1-methyl-2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]indole;2-[(3-methyl-5-propan-2-ylpiperidin-1-yl)methyl]quinoline;(3S)-1-(naphthalen-1-ylmethyl)-3-propan-2-ylpiperidine;2-phenyl-5-propan-2-ylpiperidine;4-[(3-propan-2-ylpiperidin-1-yl)methyl]quinoline is sourced from PubChem (CID 161410386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).