N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide

C195H201F10N17O10 — CID 158397935

IUPACN-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide
SMILESCC(C)CNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1.CC(F)(F)c1ccc(-c2ccccc2C(=O)Nc2ccc(C3CCN(C(C(=O)NCc4ccccn4)c4ccccc4)CC3)cc2)cc1.CC(F)(F)c1ccc(-c2ccccc2C(=O)Nc2ccc(C3CCN(C(C(=O)NCc4cccnc4)c4ccccc4)CC3)cc2)cc1.CCCCCNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1.CCCCNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1
InChIInChI=1S/2C40H38F2N4O2.C39H43F2N3O2.2C38H41F2N3O2/c1-40(41,42)32-18-14-30(15-19-32)35-12-5-6-13-36(35)38(47)45-33-20-16-28(17-21-33)29-22-25-46(26-23-29)37(31-9-3-2-4-10-31)39(48)44-27-34-11-7-8-24-43-34;1-40(41,42)33-17-13-31(14-18-33)35-11-5-6-12-36(35)38(47)45-34-19-15-29(16-20-34)30-21-24-46(25-22-30)37(32-9-3-2-4-10-32)39(48)44-27-28-8-7-23-43-26-28;1-3-4-10-25-42-38(46)36(31-11-6-5-7-12-31)44-26-23-29(24-27-44)28-17-21-33(22-18-28)43-37(45)35-14-9-8-13-34(35)30-15-19-32(20-16-30)39(2,40)41;1-26(2)25-41-37(45)35(30-9-5-4-6-10-30)43-23-21-28(22-24-43)27-15-19-32(20-16-27)42-36(44)34-12-8-7-11-33(34)29-13-17-31(18-14-29)38(3,39)40;1-3-4-24-41-37(45)35(30-10-6-5-7-11-30)43-25-22-28(23-26-43)27-16-20-32(21-17-27)42-36(44)34-13-9-8-12-33(34)29-14-18-31(19-15-29)38(2,39)40/h2-21,24,29,37H,22-23,25-27H2,1H3,(H,44,48)(H,45,47);2-20,23,26,30,37H,21-22,24-25,27H2,1H3,(H,44,48)(H,45,47);5-9,11-22,29,36H,3-4,10,23-27H2,1-2H3,(H,42,46)(H,43,45);4-20,26,28,35H,21-25H2,1-3H3,(H,41,45)(H,42,44);5-21,28,35H,3-4,22-26H2,1-2H3,(H,41,45)(H,42,44)
InChIKeyGXSYOCIZIXJTHC-UHFFFAOYSA-N
MW3132.84 g/mol
LogP42.61
Rot. Bonds53

About N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide

N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide (PubChem CID 158397935) has the molecular formula C195H201F10N17O10 and a molecular weight of 3132.84 g/mol. Its IUPAC name is N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide.

Molecular Properties

Compound NameN-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide
PubChem CID158397935
Molecular FormulaC195H201F10N17O10
Molecular Weight3132.84 g/mol
Exact Mass3130.56
IUPAC NameN-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide
SMILESCC(C)CNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1.CC(F)(F)c1ccc(-c2ccccc2C(=O)Nc2ccc(C3CCN(C(C(=O)NCc4ccccn4)c4ccccc4)CC3)cc2)cc1.CC(F)(F)c1ccc(-c2ccccc2C(=O)Nc2ccc(C3CCN(C(C(=O)NCc4cccnc4)c4ccccc4)CC3)cc2)cc1.CCCCCNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1.CCCCNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1
InChIInChI=1S/2C40H38F2N4O2.C39H43F2N3O2.2C38H41F2N3O2/c1-40(41,42)32-18-14-30(15-19-32)35-12-5-6-13-36(35)38(47)45-33-20-16-28(17-21-33)29-22-25-46(26-23-29)37(31-9-3-2-4-10-31)39(48)44-27-34-11-7-8-24-43-34;1-40(41,42)33-17-13-31(14-18-33)35-11-5-6-12-36(35)38(47)45-34-19-15-29(16-20-34)30-21-24-46(25-22-30)37(32-9-3-2-4-10-32)39(48)44-27-28-8-7-23-43-26-28;1-3-4-10-25-42-38(46)36(31-11-6-5-7-12-31)44-26-23-29(24-27-44)28-17-21-33(22-18-28)43-37(45)35-14-9-8-13-34(35)30-15-19-32(20-16-30)39(2,40)41;1-26(2)25-41-37(45)35(30-9-5-4-6-10-30)43-23-21-28(22-24-43)27-15-19-32(20-16-27)42-36(44)34-12-8-7-11-33(34)29-13-17-31(18-14-29)38(3,39)40;1-3-4-24-41-37(45)35(30-10-6-5-7-11-30)43-25-22-28(23-26-43)27-16-20-32(21-17-27)42-36(44)34-13-9-8-12-33(34)29-14-18-31(19-15-29)38(2,39)40/h2-21,24,29,37H,22-23,25-27H2,1H3,(H,44,48)(H,45,47);2-20,23,26,30,37H,21-22,24-25,27H2,1H3,(H,44,48)(H,45,47);5-9,11-22,29,36H,3-4,10,23-27H2,1-2H3,(H,42,46)(H,43,45);4-20,26,28,35H,21-25H2,1-3H3,(H,41,45)(H,42,44);5-21,28,35H,3-4,22-26H2,1-2H3,(H,41,45)(H,42,44)
InChIKeyGXSYOCIZIXJTHC-UHFFFAOYSA-N
XLogP42.61
TPSA332.98 Ų
H-Bond Donors10
H-Bond Acceptors17
Rotatable Bonds53
Heavy Atoms232
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003132.84
LogP ≤ 542.61
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide with MolForge

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Related Compounds

Jnj-31020028
CID 25134625
N-[4-[4-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]piperazin-1-yl]-3-fluorophenyl]-2-pyridin-3-ylbenzamide
CID 25151875
Cathepsin Inhibitor, Column 2 Row 2
CID 71463526
(3R,5S)-3,5-Dimethyl-1-({4-[2-({4-[(4-Fluorophenyl)methyl]piperidin-1-yl}carbonyl)pyridin-3-yl]phenyl}methyl)piperazine
CID 11993730
(3-(4-(((3R,5S)-3,5-dimethylpiperazin-1-yl)methyl)phenyl)pyridin-2-yl)(4-(4-fluorophenylamino)piperidin-1-yl)methanone
CID 16040587
[3-[4-[[(3R,5S)-3,5-dimethylpiperazin-1-yl]methyl]-3-fluorophenyl]-2-pyridinyl]-[4-(4-fluoroanilino)piperidin-1-yl]methanone
CID 16040939
[3-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]-2-pyridinyl]-[4-(3-fluoroanilino)piperidin-1-yl]methanone
CID 16040940
[3-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]-3-fluorophenyl]-2-pyridinyl]-[4-(3-fluoroanilino)piperidin-1-yl]methanone
CID 16040941
[4-(3,4-difluoroanilino)piperidin-1-yl]-[3-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]-2-pyridinyl]methanone
CID 16041119
[3-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]-2-pyridinyl]-[4-(2-fluoroanilino)piperidin-1-yl]methanone
CID 16041483
(R)-N-(4-(4-(2-(diethylamino)-2-oxo-1-phenylethyl)piperazin-1-yl)-3-fluorophenyl)-2-(pyridin-3-yl)benzamide
CID 25151876
N-[4-[4-[2-(ethylamino)-2-oxo-1-phenylethyl]piperazin-1-yl]-3-fluorophenyl]-2-pyridin-3-ylbenzamide
CID 25151877

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide?
The IUPAC name of N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide (CID 158397935) is N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide.
What is the SMILES notation for N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide?
The canonical SMILES for N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide is CC(C)CNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1.CC(F)(F)c1ccc(-c2ccccc2C(=O)Nc2ccc(C3CCN(C(C(=O)NCc4ccccn4)c4ccccc4)CC3)cc2)cc1.CC(F)(F)c1ccc(-c2ccccc2C(=O)Nc2ccc(C3CCN(C(C(=O)NCc4cccnc4)c4ccccc4)CC3)cc2)cc1.CCCCCNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1.CCCCNC(=O)C(c1ccccc1)N1CCC(c2ccc(NC(=O)c3ccccc3-c3ccc(C(C)(F)F)cc3)cc2)CC1.
What is the InChIKey of N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide?
The InChIKey is GXSYOCIZIXJTHC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C40H38F2N4O2.C39H43F2N3O2.2C38H41F2N3O2/c1-40(41,42)32-18-14-30(15-19-32)35-12-5-6-13-36(35)38(47)45-33-20-16-28(17-21-33)29-22-25-46(26-23-29)37(31-9-3-2-4-10-31)39(48)44-27-34-11-7-8-24-43-34;1-40(41,42)33-17-13-31(14-18-33)35-11-5-6-12-36(35)38(47)45-34-19-15-29(16-20-34)30-21-24-46(25-22-30)37(32-9-3-2-4-10-32)39(48)44-27-28-8-7-23-43-26-28;1-3-4-10-25-42-38(46)36(31-11-6-5-7-12-31)44-26-23-29(24-27-44)28-17-21-33(22-18-28)43-37(45)35-14-9-8-13-34(35)30-15-19-32(20-16-30)39(2,40)41;1-26(2)25-41-37(45)35(30-9-5-4-6-10-30)43-23-21-28(22-24-43)27-15-19-32(20-16-27)42-36(44)34-12-8-7-11-33(34)29-13-17-31(18-14-29)38(3,39)40;1-3-4-24-41-37(45)35(30-10-6-5-7-11-30)43-25-22-28(23-26-43)27-16-20-32(21-17-27)42-36(44)34-13-9-8-12-33(34)29-14-18-31(19-15-29)38(2,39)40/h2-21,24,29,37H,22-23,25-27H2,1H3,(H,44,48)(H,45,47);2-20,23,26,30,37H,21-22,24-25,27H2,1H3,(H,44,48)(H,45,47);5-9,11-22,29,36H,3-4,10,23-27H2,1-2H3,(H,42,46)(H,43,45);4-20,26,28,35H,21-25H2,1-3H3,(H,41,45)(H,42,44);5-21,28,35H,3-4,22-26H2,1-2H3,(H,41,45)(H,42,44).
What are the key properties of N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide?
N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide has a molecular weight of 3132.84 g/mol, XLogP of 42.61, 53 rotatable bonds, 10 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-[2-(butylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]-2-[4-(1,1-difluoroethyl)phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-(2-methylpropylamino)-2-oxo-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-2-(pentylamino)-1-phenylethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-2-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide;2-[4-(1,1-difluoroethyl)phenyl]-N-[4-[1-[2-oxo-1-phenyl-2-(pyridin-3-ylmethylamino)ethyl]piperidin-4-yl]phenyl]benzamide is sourced from PubChem (CID 158397935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).