2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate

C160H187N25O15S — CID 158226656

IUPAC2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate
SMILESCC(C)(C)OC(=O)NC1CCN(CC(=O)NCC(Cc2cccnc2)c2ccccc2)C1.O=C(CN1CCC(NC(=O)Cc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)Nc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)Oc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)c2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NS(=O)(=O)c2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1
InChIInChI=1S/C28H32N4O2.C27H31N5O2.C27H30N4O3.C27H30N4O2.C26H30N4O3S.C25H34N4O3/c33-27(17-22-8-3-1-4-9-22)31-26-13-15-32(20-26)21-28(34)30-19-25(24-11-5-2-6-12-24)16-23-10-7-14-29-18-23;33-26(20-32-15-13-25(19-32)31-27(34)30-24-11-5-2-6-12-24)29-18-23(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;32-26(20-31-15-13-24(19-31)30-27(33)34-25-11-5-2-6-12-25)29-18-23(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;32-26(20-31-15-13-25(19-31)30-27(33)23-11-5-2-6-12-23)29-18-24(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;31-26(20-30-15-13-24(19-30)29-34(32,33)25-11-5-2-6-12-25)28-18-23(22-9-3-1-4-10-22)16-21-8-7-14-27-17-21;1-25(2,3)32-24(31)28-22-11-13-29(17-22)18-23(30)27-16-21(20-9-5-4-6-10-20)14-19-8-7-12-26-15-19/h1-12,14,18,25-26H,13,15-17,19-21H2,(H,30,34)(H,31,33);1-12,14,17,23,25H,13,15-16,18-20H2,(H,29,33)(H2,30,31,34);1-12,14,17,23-24H,13,15-16,18-20H2,(H,29,32)(H,30,33);1-12,14,17,24-25H,13,15-16,18-20H2,(H,29,32)(H,30,33);1-12,14,17,23-24,29H,13,15-16,18-20H2,(H,28,31);4-10,12,15,21-22H,11,13-14,16-18H2,1-3H3,(H,27,30)(H,28,31)
InChIKeyGDWKQHYFWHMODW-UHFFFAOYSA-N
MW2732.48 g/mol
LogP18.49
Rot. Bonds55

About 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate

2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate (PubChem CID 158226656) has the molecular formula C160H187N25O15S and a molecular weight of 2732.48 g/mol. Its IUPAC name is 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate.

Molecular Properties

Compound Name2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate
PubChem CID158226656
Molecular FormulaC160H187N25O15S
Molecular Weight2732.48 g/mol
Exact Mass2730.44
IUPAC Name2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate
SMILESCC(C)(C)OC(=O)NC1CCN(CC(=O)NCC(Cc2cccnc2)c2ccccc2)C1.O=C(CN1CCC(NC(=O)Cc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)Nc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)Oc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)c2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NS(=O)(=O)c2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1
InChIInChI=1S/C28H32N4O2.C27H31N5O2.C27H30N4O3.C27H30N4O2.C26H30N4O3S.C25H34N4O3/c33-27(17-22-8-3-1-4-9-22)31-26-13-15-32(20-26)21-28(34)30-19-25(24-11-5-2-6-12-24)16-23-10-7-14-29-18-23;33-26(20-32-15-13-25(19-32)31-27(34)30-24-11-5-2-6-12-24)29-18-23(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;32-26(20-31-15-13-24(19-31)30-27(33)34-25-11-5-2-6-12-25)29-18-23(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;32-26(20-31-15-13-25(19-31)30-27(33)23-11-5-2-6-12-23)29-18-24(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;31-26(20-30-15-13-24(19-30)29-34(32,33)25-11-5-2-6-12-25)28-18-23(22-9-3-1-4-10-22)16-21-8-7-14-27-17-21;1-25(2,3)32-24(31)28-22-11-13-29(17-22)18-23(30)27-16-21(20-9-5-4-6-10-20)14-19-8-7-12-26-15-19/h1-12,14,18,25-26H,13,15-17,19-21H2,(H,30,34)(H,31,33);1-12,14,17,23,25H,13,15-16,18-20H2,(H,29,33)(H2,30,31,34);1-12,14,17,23-24H,13,15-16,18-20H2,(H,29,32)(H,30,33);1-12,14,17,24-25H,13,15-16,18-20H2,(H,29,32)(H,30,33);1-12,14,17,23-24,29H,13,15-16,18-20H2,(H,28,31);4-10,12,15,21-22H,11,13-14,16-18H2,1-3H3,(H,27,30)(H,28,31)
InChIKeyGDWKQHYFWHMODW-UHFFFAOYSA-N
XLogP18.49
TPSA493.54 Ų
H-Bond Donors13
H-Bond Acceptors27
Rotatable Bonds55
Heavy Atoms201
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002732.48
LogP ≤ 518.49
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1027

Analyze 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate with MolForge

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Related Compounds

(2S)-2-amino-6-(benzenesulfonamido)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)hexanamide;N-[(5S)-5-amino-6-(1,2,3,4-tetrahydronaphthalen-2-ylamino)hexyl]benzenesulfonamide;2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;2-fluoro-N-[[4-[[(6-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]methyl]cyclohexyl]methyl]benzenesulfonamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate
CID 157802588
2-[4-(benzenesulfonamido)piperidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]-2-phenylacetamide;2-[4-(phenylcarbamoylamino)piperidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]carbamate
CID 158685261
2-[4-(benzenesulfonamido)piperidin-1-yl]-N-[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]carbamate;N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]-2-phenylacetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]carbamate
CID 158813608
(2S)-3-[4-[4-[2,6-bis(methoxycarbonylamino)hexanoyl]piperazine-1-carbonyl]oxyphenyl]-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-[4-(propoxycarbonylamino)benzoyl]piperazine-1-carbonyl]oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-(4-propoxycarbonylpiperazine-1-carbonyl)oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-[4-(propylcarbamoylamino)benzoyl]piperazine-1-carbonyl]oxyphenyl]propanoic acid
CID 159605813
(2S)-3-[4-[4-[2,6-bis(methoxycarbonylamino)hexanoyl]piperazine-1-carbonyl]oxyphenyl]-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-[4-(propoxycarbonylamino)benzoyl]piperazine-1-carbonyl]oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-(4-propoxycarbonylpiperazine-1-carbonyl)oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-[4-(propylcarbamoylamino)benzoyl]piperazine-1-carbonyl]oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-(propylcarbamoyl)piperazine-1-carbonyl]oxyphenyl]propanoic acid
CID 159837327
2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-[1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide;tert-butyl N-[1-[2-oxo-2-[[1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]ethyl]pyrrolidin-3-yl]carbamate;N-[2-(4-hydroxyphenyl)-3-pyridin-3-ylpropyl]-2-(4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)acetamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;N-[1-[2-oxo-2-[[1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[[1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-[1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide;phenyl N-[1-[2-oxo-2-[[1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]ethyl]pyrrolidin-3-yl]carbamate
CID 160082641
(2S)-3-[4-[4-[2,6-bis(methoxycarbonylamino)hexanoyl]piperazine-1-carbonyl]oxyphenyl]-2-[[(4R)-5,5-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine-4-carbonyl]amino]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-[4-(propoxycarbonylamino)benzoyl]piperazine-1-carbonyl]oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-(4-propanoylpiperazine-1-carbonyl)oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-(propylcarbamoyl)piperazine-1-carbonyl]oxyphenyl]propanoic acid
CID 160614028
(2R)-3-[4-[4-[2,6-bis(methoxycarbonylamino)hexanoyl]piperazine-1-carbonyl]oxyphenyl]-2-[[(4R)-5,5-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine-4-carbonyl]amino]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-[4-(propoxycarbonylamino)benzoyl]piperazine-1-carbonyl]oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-(4-propanoylpiperazine-1-carbonyl)oxyphenyl]propanoic acid;(2S)-2-[[(4R)-5,5-dimethyl-3-pyridin-3-ylsulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[4-[4-(propylcarbamoyl)piperazine-1-carbonyl]oxyphenyl]propanoic acid
CID 160614029
2-[4-(benzenesulfonamido)piperidin-1-yl]-N-[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide;tert-butyl N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]carbamate;N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]benzamide;N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]-2-phenylacetamide;N-[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-2-[4-(phenylcarbamoylamino)piperidin-1-yl]acetamide;phenyl N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]carbamate
CID 160845511
tert-butyl (3R,4R)-3-[[(5S)-2-tert-butyl-5-cyclohexyl-4-oxo-5-(pyrazine-2-carbonylamino)pentanoyl]amino]-4-[(3R)-8-[[(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-4,5,8-trioxo-3-propyloctanoyl]pyrrolidine-1-carboxylate;N-[(1S,4S)-1-cyclohexyl-4-[[(3R,4R)-4-(6-cyclopropyl-4,5-dioxo-3-propylhexanoyl)-1-(4-methylphenyl)sulfonylpyrrolidin-3-yl]carbamoyl]-5,5-dimethyl-2-oxohexyl]pyrazine-2-carboxamide;N-[(1S)-1-cyclohexyl-4-[[(3R,4R)-4-[(3R)-8-[[(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-4,5,8-trioxo-3-propyloctanoyl]-1-(phenylcarbamoyl)pyrrolidin-3-yl]carbamoyl]-5,5-dimethyl-2-oxohexyl]pyrazine-2-carboxamide;phenyl (3R,4R)-3-[[(5S)-2-tert-butyl-5-cyclohexyl-4-oxo-5-(pyrazine-2-carbonylamino)pentanoyl]amino]-4-[8-[[(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]amino]-4,5,8-trioxo-3-propyloctanoyl]pyrrolidine-1-carboxylate
CID 160875446
2-amino-6-(benzenesulfonamido)-N-[6-methoxy-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]hexanamide;2-amino-6-(benzenesulfonamido)-N-[1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]hexanamide;2-[4-(benzenesulfonamido)piperidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]benzamide;2-[4-(phenylcarbamoylamino)piperidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]carbamate
CID 160928898
2-[4-(benzenesulfonamido)piperidin-1-yl]-N-[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide;tert-butyl N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]carbamate;N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]benzamide;N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]-2-phenylacetamide;N-[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-2-[4-(phenylcarbamoylamino)piperidin-1-yl]acetamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]piperidin-4-yl]-2-phenylacetamide;phenyl N-[1-[2-[[6-fluoro-1-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]-2-oxoethyl]piperidin-4-yl]carbamate
CID 161267561

Frequently Asked Questions

What is the IUPAC name of 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate?
The IUPAC name of 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate (CID 158226656) is 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate.
What is the SMILES notation for 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate?
The canonical SMILES for 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate is CC(C)(C)OC(=O)NC1CCN(CC(=O)NCC(Cc2cccnc2)c2ccccc2)C1.O=C(CN1CCC(NC(=O)Cc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)Nc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)Oc2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NC(=O)c2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.O=C(CN1CCC(NS(=O)(=O)c2ccccc2)C1)NCC(Cc1cccnc1)c1ccccc1.
What is the InChIKey of 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate?
The InChIKey is GDWKQHYFWHMODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32N4O2.C27H31N5O2.C27H30N4O3.C27H30N4O2.C26H30N4O3S.C25H34N4O3/c33-27(17-22-8-3-1-4-9-22)31-26-13-15-32(20-26)21-28(34)30-19-25(24-11-5-2-6-12-24)16-23-10-7-14-29-18-23;33-26(20-32-15-13-25(19-32)31-27(34)30-24-11-5-2-6-12-24)29-18-23(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;32-26(20-31-15-13-24(19-31)30-27(33)34-25-11-5-2-6-12-25)29-18-23(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;32-26(20-31-15-13-25(19-31)30-27(33)23-11-5-2-6-12-23)29-18-24(22-9-3-1-4-10-22)16-21-8-7-14-28-17-21;31-26(20-30-15-13-24(19-30)29-34(32,33)25-11-5-2-6-12-25)28-18-23(22-9-3-1-4-10-22)16-21-8-7-14-27-17-21;1-25(2,3)32-24(31)28-22-11-13-29(17-22)18-23(30)27-16-21(20-9-5-4-6-10-20)14-19-8-7-12-26-15-19/h1-12,14,18,25-26H,13,15-17,19-21H2,(H,30,34)(H,31,33);1-12,14,17,23,25H,13,15-16,18-20H2,(H,29,33)(H2,30,31,34);1-12,14,17,23-24H,13,15-16,18-20H2,(H,29,32)(H,30,33);1-12,14,17,24-25H,13,15-16,18-20H2,(H,29,32)(H,30,33);1-12,14,17,23-24,29H,13,15-16,18-20H2,(H,28,31);4-10,12,15,21-22H,11,13-14,16-18H2,1-3H3,(H,27,30)(H,28,31).
What are the key properties of 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate?
2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate has a molecular weight of 2732.48 g/mol, XLogP of 18.49, 55 rotatable bonds, 13 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(benzenesulfonamido)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;tert-butyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]benzamide;N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]-2-phenylacetamide;2-[3-(phenylcarbamoylamino)pyrrolidin-1-yl]-N-(2-phenyl-3-pyridin-3-ylpropyl)acetamide;phenyl N-[1-[2-oxo-2-[(2-phenyl-3-pyridin-3-ylpropyl)amino]ethyl]pyrrolidin-3-yl]carbamate is sourced from PubChem (CID 158226656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).