N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide

C135H158Cl6N22O14S2 — CID 158460690

IUPACN-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
SMILESCN1CCCC(CC(=O)CC2CCN(c3ncc(C#N)cc3NC(=O)c3cccc(Cl)c3)CC2)C1.CN1CCCN(C(=O)CC2CCN(c3ncc(-c4ccccc4)cc3NC(=O)c3cccc(Cl)c3)CC2)CC1.CS(=O)(=O)c1cnc(N2CCC(CC(=O)NCc3ccccc3)CC2)c(NC(=O)c2cccc(Cl)c2)c1.C[C@H]1CCCCN1C(=O)CC1CCN(c2ncc(S(C)(=O)=O)cc2NC(=O)c2cccc(Cl)c2)CC1.O=C(Nc1cc(Cl)cnc1N1CCC(CC(=O)N2CCCCC2)CC1)c1cccc(Cl)c1
InChIInChI=1S/C31H36ClN5O2.C27H32ClN5O2.C27H29ClN4O4S.C26H33ClN4O4S.C24H28Cl2N4O2/c1-35-13-6-14-36(18-17-35)29(38)19-23-11-15-37(16-12-23)30-28(34-31(39)25-9-5-10-27(32)20-25)21-26(22-33-30)24-7-3-2-4-8-24;1-32-9-3-4-20(18-32)13-24(34)12-19-7-10-33(11-8-19)26-25(14-21(16-29)17-30-26)31-27(35)22-5-2-6-23(28)15-22;1-37(35,36)23-16-24(31-27(34)21-8-5-9-22(28)15-21)26(30-18-23)32-12-10-19(11-13-32)14-25(33)29-17-20-6-3-2-4-7-20;1-18-6-3-4-11-31(18)24(32)14-19-9-12-30(13-10-19)25-23(16-22(17-28-25)36(2,34)35)29-26(33)20-7-5-8-21(27)15-20;25-19-6-4-5-18(14-19)24(32)28-21-15-20(26)16-27-23(21)30-11-7-17(8-12-30)13-22(31)29-9-2-1-3-10-29/h2-5,7-10,20-23H,6,11-19H2,1H3,(H,34,39);2,5-6,14-15,17,19-20H,3-4,7-13,18H2,1H3,(H,31,35);2-9,15-16,18-19H,10-14,17H2,1H3,(H,29,33)(H,31,34);5,7-8,15-19H,3-4,6,9-14H2,1-2H3,(H,29,33);4-6,14-17H,1-3,7-13H2,(H,28,32)/t;;;18-;/m...0./s1
InChIKeyHFDBWEJYLXPXDB-UKMBNQFUSA-N
MW2589.74 g/mol
LogP24.16
Rot. Bonds32

About N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide

N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide (PubChem CID 158460690) has the molecular formula C135H158Cl6N22O14S2 and a molecular weight of 2589.74 g/mol. Its IUPAC name is N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide.

Molecular Properties

Compound NameN-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
PubChem CID158460690
Molecular FormulaC135H158Cl6N22O14S2
Molecular Weight2589.74 g/mol
Exact Mass2584.99
IUPAC NameN-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
SMILESCN1CCCC(CC(=O)CC2CCN(c3ncc(C#N)cc3NC(=O)c3cccc(Cl)c3)CC2)C1.CN1CCCN(C(=O)CC2CCN(c3ncc(-c4ccccc4)cc3NC(=O)c3cccc(Cl)c3)CC2)CC1.CS(=O)(=O)c1cnc(N2CCC(CC(=O)NCc3ccccc3)CC2)c(NC(=O)c2cccc(Cl)c2)c1.C[C@H]1CCCCN1C(=O)CC1CCN(c2ncc(S(C)(=O)=O)cc2NC(=O)c2cccc(Cl)c2)CC1.O=C(Nc1cc(Cl)cnc1N1CCC(CC(=O)N2CCCCC2)CC1)c1cccc(Cl)c1
InChIInChI=1S/C31H36ClN5O2.C27H32ClN5O2.C27H29ClN4O4S.C26H33ClN4O4S.C24H28Cl2N4O2/c1-35-13-6-14-36(18-17-35)29(38)19-23-11-15-37(16-12-23)30-28(34-31(39)25-9-5-10-27(32)20-25)21-26(22-33-30)24-7-3-2-4-8-24;1-32-9-3-4-20(18-32)13-24(34)12-19-7-10-33(11-8-19)26-25(14-21(16-29)17-30-26)31-27(35)22-5-2-6-23(28)15-22;1-37(35,36)23-16-24(31-27(34)21-8-5-9-22(28)15-21)26(30-18-23)32-12-10-19(11-13-32)14-25(33)29-17-20-6-3-2-4-7-20;1-18-6-3-4-11-31(18)24(32)14-19-9-12-30(13-10-19)25-23(16-22(17-28-25)36(2,34)35)29-26(33)20-7-5-8-21(27)15-20;25-19-6-4-5-18(14-19)24(32)28-21-15-20(26)16-27-23(21)30-11-7-17(8-12-30)13-22(31)29-9-2-1-3-10-29/h2-5,7-10,20-23H,6,11-19H2,1H3,(H,34,39);2,5-6,14-15,17,19-20H,3-4,7-13,18H2,1H3,(H,31,35);2-9,15-16,18-19H,10-14,17H2,1H3,(H,29,33)(H,31,34);5,7-8,15-19H,3-4,6,9-14H2,1-2H3,(H,29,33);4-6,14-17H,1-3,7-13H2,(H,28,32)/t;;;18-;/m...0./s1
InChIKeyHFDBWEJYLXPXDB-UKMBNQFUSA-N
XLogP24.16
TPSA431.80 Ų
H-Bond Donors6
H-Bond Acceptors27
Rotatable Bonds32
Heavy Atoms179
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002589.74
LogP ≤ 524.16
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1027

Analyze N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide with MolForge

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Launch Full Analysis

Related Compounds

3-[(3-chlorobenzoyl)-[2-[4-[2-(4-cyanoanilino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]amino]-2-[2-[3-chloro-4-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]piperidin-2-yl]-3-pyridinyl]-5-methylsulfonylbenzamide;3-chloro-N-[5-methylsulfonyl-2-[4-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]piperidin-1-yl]-3-pyridinyl]benzamide
CID 87376549
3-chloro-N-[2-[4-(4,4-dimethyl-2-oxopentyl)piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[3-(4-fluoro-4-methylcyclohexyl)-2-oxopropyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[5-cyano-2-[4-[3-[(3S)-1-methylpiperidin-3-yl]-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]-3-(trifluoromethyl)benzamide
CID 161234712
N-[2-[4-[3-[(3R)-1-acetylpiperidin-3-yl]-2-oxopropyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;3-chloro-N-[5-chloro-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-[3-[(3S)-1-methylpiperidin-3-yl]-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-3-pyridinyl]benzamide;N-[2-[4-[3-[(3R)-1-methylpiperidin-3-yl]-2-oxopropyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-(trifluoromethyl)benzamide
CID 161311052
3-chloro-N-[5-chloro-2-[4-(4-methyl-2-oxo-4-phenylpentyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-3-phenylpropyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[3-(4-methylcyclohexyl)-2-oxopropyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;N-[2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-(trifluoromethyl)benzamide;N-[2-[4-[3-[(3S)-1-methylpiperidin-3-yl]-2-oxopropyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-(trifluoromethyl)benzamide
CID 161821001
3-chloro-N-[2-[4-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
CID 67323187
3-chloro-N-[5-methylsulfonyl-2-[4-[2-oxo-2-(1-pyridin-3-ylethylamino)ethyl]piperidin-1-yl]-3-pyridinyl]benzamide
CID 67341160
N-[2-[4-[2-[(1-acetylpiperidin-4-yl)amino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide
CID 67341256
N-[2-[4-[2-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide
CID 67341453
3-chloro-N-[5-methylsulfonyl-2-[4-[2-oxo-2-[[(1S)-1-phenylpropyl]amino]ethyl]piperidin-1-yl]-3-pyridinyl]benzamide
CID 67341746
3-chloro-N-[5-methylsulfonyl-2-[4-[2-oxo-2-[[(1R)-1-phenylpropyl]amino]ethyl]piperidin-1-yl]-3-pyridinyl]benzamide
CID 67345521
3-chloro-N-[2-[4-[2-[[(1S)-1-cyclohexylethyl]amino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[cyclopropyl(methyl)amino]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
CID 87362839
3-chloro-N-[2-[4-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methoxypiperidin-1-yl)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide
CID 87377688

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?
The IUPAC name of N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide (CID 158460690) is N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide.
What is the SMILES notation for N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?
The canonical SMILES for N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide is CN1CCCC(CC(=O)CC2CCN(c3ncc(C#N)cc3NC(=O)c3cccc(Cl)c3)CC2)C1.CN1CCCN(C(=O)CC2CCN(c3ncc(-c4ccccc4)cc3NC(=O)c3cccc(Cl)c3)CC2)CC1.CS(=O)(=O)c1cnc(N2CCC(CC(=O)NCc3ccccc3)CC2)c(NC(=O)c2cccc(Cl)c2)c1.C[C@H]1CCCCN1C(=O)CC1CCN(c2ncc(S(C)(=O)=O)cc2NC(=O)c2cccc(Cl)c2)CC1.O=C(Nc1cc(Cl)cnc1N1CCC(CC(=O)N2CCCCC2)CC1)c1cccc(Cl)c1.
What is the InChIKey of N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?
The InChIKey is HFDBWEJYLXPXDB-UKMBNQFUSA-N. The full InChI is InChI=1S/C31H36ClN5O2.C27H32ClN5O2.C27H29ClN4O4S.C26H33ClN4O4S.C24H28Cl2N4O2/c1-35-13-6-14-36(18-17-35)29(38)19-23-11-15-37(16-12-23)30-28(34-31(39)25-9-5-10-27(32)20-25)21-26(22-33-30)24-7-3-2-4-8-24;1-32-9-3-4-20(18-32)13-24(34)12-19-7-10-33(11-8-19)26-25(14-21(16-29)17-30-26)31-27(35)22-5-2-6-23(28)15-22;1-37(35,36)23-16-24(31-27(34)21-8-5-9-22(28)15-21)26(30-18-23)32-12-10-19(11-13-32)14-25(33)29-17-20-6-3-2-4-7-20;1-18-6-3-4-11-31(18)24(32)14-19-9-12-30(13-10-19)25-23(16-22(17-28-25)36(2,34)35)29-26(33)20-7-5-8-21(27)15-20;25-19-6-4-5-18(14-19)24(32)28-21-15-20(26)16-27-23(21)30-11-7-17(8-12-30)13-22(31)29-9-2-1-3-10-29/h2-5,7-10,20-23H,6,11-19H2,1H3,(H,34,39);2,5-6,14-15,17,19-20H,3-4,7-13,18H2,1H3,(H,31,35);2-9,15-16,18-19H,10-14,17H2,1H3,(H,29,33)(H,31,34);5,7-8,15-19H,3-4,6,9-14H2,1-2H3,(H,29,33);4-6,14-17H,1-3,7-13H2,(H,28,32)/t;;;18-;/m...0./s1.
What are the key properties of N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide?
N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide has a molecular weight of 2589.74 g/mol, XLogP of 24.16, 32 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-[2-(benzylamino)-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]-3-chlorobenzamide;3-chloro-N-[5-chloro-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[5-cyano-2-[4-[3-(1-methylpiperidin-3-yl)-2-oxopropyl]piperidin-1-yl]-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]piperidin-1-yl]-5-phenyl-3-pyridinyl]benzamide;3-chloro-N-[2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperidin-1-yl]-5-methylsulfonyl-3-pyridinyl]benzamide is sourced from PubChem (CID 158460690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).