N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide

C258H302N16O8 — CID 158433210

IUPACN-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide
SMILESC=CCN(C(=O)c1ccc(C2CCC(N3CCC4(C=Cc5ccccc54)[C@@H](C)C3)C2)cc1)c1ccccc1.CCNC(=O)c1ccc(C2CCC(N3CCC4(C=Cc5ccccc54)[C@@H](C)C3)C2)cc1.C[C@H]1CN(C2CCC(c3ccc(C(=O)N4CCCCC4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NC(C)(C)C)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NC4CCCCC4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCCCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12
InChIInChI=1S/C35H40N2O.C35H38N2O.C34H38N2O.C33H36N2O.C32H40N2O.C31H38N2O.C30H38N2O.C28H34N2O/c1-26-25-37(23-21-35(26)20-19-29-11-5-6-12-33(29)35)32-18-17-31(24-32)28-13-15-30(16-14-28)34(38)36-22-7-10-27-8-3-2-4-9-27;1-3-22-37(31-10-5-4-6-11-31)34(38)29-15-13-27(14-16-29)30-17-18-32(24-30)36-23-21-35(26(2)25-36)20-19-28-9-7-8-12-33(28)35;1-25-24-36(22-20-34(25)19-17-28-9-5-6-10-32(28)34)31-16-15-30(23-31)27-11-13-29(14-12-27)33(37)35-21-18-26-7-3-2-4-8-26;1-24-23-35(20-19-33(24)18-17-27-9-5-6-10-31(27)33)30-16-15-29(21-30)26-11-13-28(14-12-26)32(36)34-22-25-7-3-2-4-8-25;1-23-22-34(20-19-32(23)18-17-25-7-5-6-10-30(25)32)29-16-15-27(21-29)24-11-13-26(14-12-24)31(35)33-28-8-3-2-4-9-28;1-23-22-33(20-17-31(23)16-15-25-7-3-4-8-29(25)31)28-14-13-27(21-28)24-9-11-26(12-10-24)30(34)32-18-5-2-6-19-32;1-21-20-32(18-17-30(21)16-15-23-7-5-6-8-27(23)30)26-14-13-25(19-26)22-9-11-24(12-10-22)28(33)31-29(2,3)4;1-3-29-27(31)23-10-8-21(9-11-23)24-12-13-25(18-24)30-17-16-28(20(2)19-30)15-14-22-6-4-5-7-26(22)28/h2-6,8-9,11-16,19-20,26,31-32H,7,10,17-18,21-25H2,1H3,(H,36,38);3-16,19-20,26,30,32H,1,17-18,21-25H2,2H3;2-14,17,19,25,30-31H,15-16,18,20-24H2,1H3,(H,35,37);2-14,17-18,24,29-30H,15-16,19-23H2,1H3,(H,34,36);5-7,10-14,17-18,23,27-29H,2-4,8-9,15-16,19-22H2,1H3,(H,33,35);3-4,7-12,15-16,23,27-28H,2,5-6,13-14,17-22H2,1H3;5-12,15-16,21,25-26H,13-14,17-20H2,1-4H3,(H,31,33);4-11,14-15,20,24-25H,3,12-13,16-19H2,1-2H3,(H,29,31)/t26-,31?,32?,35?;26-,30?,32?,35?;25-,30?,31?,34?;24-,29?,30?,33?;23-,27?,29?,32?;23-,27?,28?,31?;21-,25?,26?,30?;20-,24?,25?,28?/m00000000/s1
InChIKeyHBXHSUSCYKPTLD-CRCZMKSNSA-N
MW3755.36 g/mol
LogP52.10
Rot. Bonds38

About N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide

N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide (PubChem CID 158433210) has the molecular formula C258H302N16O8 and a molecular weight of 3755.36 g/mol. Its IUPAC name is N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide.

Molecular Properties

Compound NameN-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide
PubChem CID158433210
Molecular FormulaC258H302N16O8
Molecular Weight3755.36 g/mol
Exact Mass3752.37
IUPAC NameN-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide
SMILESC=CCN(C(=O)c1ccc(C2CCC(N3CCC4(C=Cc5ccccc54)[C@@H](C)C3)C2)cc1)c1ccccc1.CCNC(=O)c1ccc(C2CCC(N3CCC4(C=Cc5ccccc54)[C@@H](C)C3)C2)cc1.C[C@H]1CN(C2CCC(c3ccc(C(=O)N4CCCCC4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NC(C)(C)C)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NC4CCCCC4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCCCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12
InChIInChI=1S/C35H40N2O.C35H38N2O.C34H38N2O.C33H36N2O.C32H40N2O.C31H38N2O.C30H38N2O.C28H34N2O/c1-26-25-37(23-21-35(26)20-19-29-11-5-6-12-33(29)35)32-18-17-31(24-32)28-13-15-30(16-14-28)34(38)36-22-7-10-27-8-3-2-4-9-27;1-3-22-37(31-10-5-4-6-11-31)34(38)29-15-13-27(14-16-29)30-17-18-32(24-30)36-23-21-35(26(2)25-36)20-19-28-9-7-8-12-33(28)35;1-25-24-36(22-20-34(25)19-17-28-9-5-6-10-32(28)34)31-16-15-30(23-31)27-11-13-29(14-12-27)33(37)35-21-18-26-7-3-2-4-8-26;1-24-23-35(20-19-33(24)18-17-27-9-5-6-10-31(27)33)30-16-15-29(21-30)26-11-13-28(14-12-26)32(36)34-22-25-7-3-2-4-8-25;1-23-22-34(20-19-32(23)18-17-25-7-5-6-10-30(25)32)29-16-15-27(21-29)24-11-13-26(14-12-24)31(35)33-28-8-3-2-4-9-28;1-23-22-33(20-17-31(23)16-15-25-7-3-4-8-29(25)31)28-14-13-27(21-28)24-9-11-26(12-10-24)30(34)32-18-5-2-6-19-32;1-21-20-32(18-17-30(21)16-15-23-7-5-6-8-27(23)30)26-14-13-25(19-26)22-9-11-24(12-10-22)28(33)31-29(2,3)4;1-3-29-27(31)23-10-8-21(9-11-23)24-12-13-25(18-24)30-17-16-28(20(2)19-30)15-14-22-6-4-5-7-26(22)28/h2-6,8-9,11-16,19-20,26,31-32H,7,10,17-18,21-25H2,1H3,(H,36,38);3-16,19-20,26,30,32H,1,17-18,21-25H2,2H3;2-14,17,19,25,30-31H,15-16,18,20-24H2,1H3,(H,35,37);2-14,17-18,24,29-30H,15-16,19-23H2,1H3,(H,34,36);5-7,10-14,17-18,23,27-29H,2-4,8-9,15-16,19-22H2,1H3,(H,33,35);3-4,7-12,15-16,23,27-28H,2,5-6,13-14,17-22H2,1H3;5-12,15-16,21,25-26H,13-14,17-20H2,1-4H3,(H,31,33);4-11,14-15,20,24-25H,3,12-13,16-19H2,1-2H3,(H,29,31)/t26-,31?,32?,35?;26-,30?,32?,35?;25-,30?,31?,34?;24-,29?,30?,33?;23-,27?,29?,32?;23-,27?,28?,31?;21-,25?,26?,30?;20-,24?,25?,28?/m00000000/s1
InChIKeyHBXHSUSCYKPTLD-CRCZMKSNSA-N
XLogP52.10
TPSA241.14 Ų
H-Bond Donors6
H-Bond Acceptors16
Rotatable Bonds38
Heavy Atoms282
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003755.36
LogP ≤ 552.10
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1016

Analyze N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide with MolForge

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Related Compounds

N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;ethane
CID 143159425
ethane;N-ethyl-4-[3-[(3'R)-3'-methylspiro[4H-azulene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide
CID 143159434
4-N-tert-butyl-1-N-(3-phenylpropyl)benzene-1,4-dicarboxamide
CID 48846619
4-(3-methylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047837
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-(cyclobutylmethyl)-3-[(1R,3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentane-1-carboxamide
CID 10145483
4-(2-ethylpiperidine-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109047836
2-[1-[[3-fluoro-5-(trifluoromethyl)phenyl]methylcarbamoyl]-3-[(1R,3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]cyclopropane-1-carboxylic acid
CID 59050040
4-(azepane-1-carbonyl)-N-tert-butylbenzamide
CID 48845413
N-(3-phenylpropyl)-3-(piperidine-1-carbonyl)benzamide
CID 109052025
2-(azepane-1-carbonyl)-N-(3-phenylpropyl)pyridine-4-carboxamide
CID 109089026
4-N-benzyl-1-N-cyclopentyl-4-N-ethylbenzene-1,4-dicarboxamide
CID 109044420
4-(morpholine-4-carbonyl)-N-(3-phenylpropyl)benzamide
CID 109045457

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide?
The IUPAC name of N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide (CID 158433210) is N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide.
What is the SMILES notation for N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide?
The canonical SMILES for N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide is C=CCN(C(=O)c1ccc(C2CCC(N3CCC4(C=Cc5ccccc54)[C@@H](C)C3)C2)cc1)c1ccccc1.CCNC(=O)c1ccc(C2CCC(N3CCC4(C=Cc5ccccc54)[C@@H](C)C3)C2)cc1.C[C@H]1CN(C2CCC(c3ccc(C(=O)N4CCCCC4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NC(C)(C)C)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NC4CCCCC4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCCCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12.C[C@H]1CN(C2CCC(c3ccc(C(=O)NCc4ccccc4)cc3)C2)CCC12C=Cc1ccccc12.
What is the InChIKey of N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide?
The InChIKey is HBXHSUSCYKPTLD-CRCZMKSNSA-N. The full InChI is InChI=1S/C35H40N2O.C35H38N2O.C34H38N2O.C33H36N2O.C32H40N2O.C31H38N2O.C30H38N2O.C28H34N2O/c1-26-25-37(23-21-35(26)20-19-29-11-5-6-12-33(29)35)32-18-17-31(24-32)28-13-15-30(16-14-28)34(38)36-22-7-10-27-8-3-2-4-9-27;1-3-22-37(31-10-5-4-6-11-31)34(38)29-15-13-27(14-16-29)30-17-18-32(24-30)36-23-21-35(26(2)25-36)20-19-28-9-7-8-12-33(28)35;1-25-24-36(22-20-34(25)19-17-28-9-5-6-10-32(28)34)31-16-15-30(23-31)27-11-13-29(14-12-27)33(37)35-21-18-26-7-3-2-4-8-26;1-24-23-35(20-19-33(24)18-17-27-9-5-6-10-31(27)33)30-16-15-29(21-30)26-11-13-28(14-12-26)32(36)34-22-25-7-3-2-4-8-25;1-23-22-34(20-19-32(23)18-17-25-7-5-6-10-30(25)32)29-16-15-27(21-29)24-11-13-26(14-12-24)31(35)33-28-8-3-2-4-9-28;1-23-22-33(20-17-31(23)16-15-25-7-3-4-8-29(25)31)28-14-13-27(21-28)24-9-11-26(12-10-24)30(34)32-18-5-2-6-19-32;1-21-20-32(18-17-30(21)16-15-23-7-5-6-8-27(23)30)26-14-13-25(19-26)22-9-11-24(12-10-22)28(33)31-29(2,3)4;1-3-29-27(31)23-10-8-21(9-11-23)24-12-13-25(18-24)30-17-16-28(20(2)19-30)15-14-22-6-4-5-7-26(22)28/h2-6,8-9,11-16,19-20,26,31-32H,7,10,17-18,21-25H2,1H3,(H,36,38);3-16,19-20,26,30,32H,1,17-18,21-25H2,2H3;2-14,17,19,25,30-31H,15-16,18,20-24H2,1H3,(H,35,37);2-14,17-18,24,29-30H,15-16,19-23H2,1H3,(H,34,36);5-7,10-14,17-18,23,27-29H,2-4,8-9,15-16,19-22H2,1H3,(H,33,35);3-4,7-12,15-16,23,27-28H,2,5-6,13-14,17-22H2,1H3;5-12,15-16,21,25-26H,13-14,17-20H2,1-4H3,(H,31,33);4-11,14-15,20,24-25H,3,12-13,16-19H2,1-2H3,(H,29,31)/t26-,31?,32?,35?;26-,30?,32?,35?;25-,30?,31?,34?;24-,29?,30?,33?;23-,27?,29?,32?;23-,27?,28?,31?;21-,25?,26?,30?;20-,24?,25?,28?/m00000000/s1.
What are the key properties of N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide?
N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide has a molecular weight of 3755.36 g/mol, XLogP of 52.10, 38 rotatable bonds, 6 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-tert-butyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-cyclohexyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;N-ethyl-4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]benzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(2-phenylethyl)benzamide;[4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]phenyl]-piperidin-1-ylmethanone;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-phenyl-N-prop-2-enylbenzamide;4-[3-[(3'R)-3'-methylspiro[indene-1,4'-piperidine]-1'-yl]cyclopentyl]-N-(3-phenylpropyl)benzamide is sourced from PubChem (CID 158433210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).