6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide

C244H266Br2Cl5F15N40O20 — CID 158288517

IUPAC6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3Br)CC2)nc1.CC(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.CCC(CC)C(=O)N1CCN(c2ccc(C(=O)NCCCc3ccccc3)cn2)CC1.CCCCCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.CCCCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCCc1ccccc1)c1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Cl)CC2)nc1.O=C(NCCCc1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCc1cccc(Cl)c1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCc1ccccc1)c1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Cl)CC2)nc1.O=C(NCCc1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3Br)CC2)nc1
InChIInChI=1S/C27H27F3N4O2.C26H26Cl2N4O2.C26H24ClF3N4O2.C25H25BrN4O2.C25H24Cl2N4O2.C25H34N4O2.2C23H27F3N4O2.C22H27BrN4O2.C22H25F3N4O2/c28-27(29,30)23-11-5-4-10-22(23)26(36)34-17-15-33(16-18-34)24-13-12-21(19-32-24)25(35)31-14-6-9-20-7-2-1-3-8-20;27-21-9-10-23(28)22(17-21)26(34)32-15-13-31(14-16-32)24-11-8-20(18-30-24)25(33)29-12-4-7-19-5-2-1-3-6-19;27-20-5-3-4-18(16-20)10-11-31-24(35)19-8-9-23(32-17-19)33-12-14-34(15-13-33)25(36)21-6-1-2-7-22(21)26(28,29)30;26-22-9-5-4-8-21(22)25(32)30-16-14-29(15-17-30)23-11-10-20(18-28-23)24(31)27-13-12-19-6-2-1-3-7-19;26-20-7-8-22(27)21(16-20)25(33)31-14-12-30(13-15-31)23-9-6-19(17-29-23)24(32)28-11-10-18-4-2-1-3-5-18;1-3-21(4-2)25(31)29-17-15-28(16-18-29)23-13-12-22(19-27-23)24(30)26-14-8-11-20-9-6-5-7-10-20;1-16(2)9-10-27-21(31)17-7-8-20(28-15-17)29-11-13-30(14-12-29)22(32)18-5-3-4-6-19(18)23(24,25)26;1-2-3-6-11-27-21(31)17-9-10-20(28-16-17)29-12-14-30(15-13-29)22(32)18-7-4-5-8-19(18)23(24,25)26;1-16(2)9-10-24-21(28)17-7-8-20(25-15-17)26-11-13-27(14-12-26)22(29)18-5-3-4-6-19(18)23;1-2-3-10-26-20(30)16-8-9-19(27-15-16)28-11-13-29(14-12-28)21(31)17-6-4-5-7-18(17)22(23,24)25/h1-5,7-8,10-13,19H,6,9,14-18H2,(H,31,35);1-3,5-6,8-11,17-18H,4,7,12-16H2,(H,29,33);1-9,16-17H,10-15H2,(H,31,35);1-11,18H,12-17H2,(H,27,31);1-9,16-17H,10-15H2,(H,28,32);5-7,9-10,12-13,19,21H,3-4,8,11,14-18H2,1-2H3,(H,26,30);3-8,15-16H,9-14H2,1-2H3,(H,27,31);4-5,7-10,16H,2-3,6,11-15H2,1H3,(H,27,31);3-8,15-16H,9-14H2,1-2H3,(H,24,28);4-9,15H,2-3,10-14H2,1H3,(H,26,30)
InChIKeyGLBOLECJCLMVBC-UHFFFAOYSA-N
MW4701.11 g/mol
LogP40.46
Rot. Bonds66

About 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide

6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide (PubChem CID 158288517) has the molecular formula C244H266Br2Cl5F15N40O20 and a molecular weight of 4701.11 g/mol. Its IUPAC name is 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide
PubChem CID158288517
Molecular FormulaC244H266Br2Cl5F15N40O20
Molecular Weight4701.11 g/mol
Exact Mass4693.76
IUPAC Name6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3Br)CC2)nc1.CC(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.CCC(CC)C(=O)N1CCN(c2ccc(C(=O)NCCCc3ccccc3)cn2)CC1.CCCCCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.CCCCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCCc1ccccc1)c1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Cl)CC2)nc1.O=C(NCCCc1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCc1cccc(Cl)c1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCc1ccccc1)c1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Cl)CC2)nc1.O=C(NCCc1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3Br)CC2)nc1
InChIInChI=1S/C27H27F3N4O2.C26H26Cl2N4O2.C26H24ClF3N4O2.C25H25BrN4O2.C25H24Cl2N4O2.C25H34N4O2.2C23H27F3N4O2.C22H27BrN4O2.C22H25F3N4O2/c28-27(29,30)23-11-5-4-10-22(23)26(36)34-17-15-33(16-18-34)24-13-12-21(19-32-24)25(35)31-14-6-9-20-7-2-1-3-8-20;27-21-9-10-23(28)22(17-21)26(34)32-15-13-31(14-16-32)24-11-8-20(18-30-24)25(33)29-12-4-7-19-5-2-1-3-6-19;27-20-5-3-4-18(16-20)10-11-31-24(35)19-8-9-23(32-17-19)33-12-14-34(15-13-33)25(36)21-6-1-2-7-22(21)26(28,29)30;26-22-9-5-4-8-21(22)25(32)30-16-14-29(15-17-30)23-11-10-20(18-28-23)24(31)27-13-12-19-6-2-1-3-7-19;26-20-7-8-22(27)21(16-20)25(33)31-14-12-30(13-15-31)23-9-6-19(17-29-23)24(32)28-11-10-18-4-2-1-3-5-18;1-3-21(4-2)25(31)29-17-15-28(16-18-29)23-13-12-22(19-27-23)24(30)26-14-8-11-20-9-6-5-7-10-20;1-16(2)9-10-27-21(31)17-7-8-20(28-15-17)29-11-13-30(14-12-29)22(32)18-5-3-4-6-19(18)23(24,25)26;1-2-3-6-11-27-21(31)17-9-10-20(28-16-17)29-12-14-30(15-13-29)22(32)18-7-4-5-8-19(18)23(24,25)26;1-16(2)9-10-24-21(28)17-7-8-20(25-15-17)26-11-13-27(14-12-26)22(29)18-5-3-4-6-19(18)23;1-2-3-10-26-20(30)16-8-9-19(27-15-16)28-11-13-29(14-12-28)21(31)17-6-4-5-7-18(17)22(23,24)25/h1-5,7-8,10-13,19H,6,9,14-18H2,(H,31,35);1-3,5-6,8-11,17-18H,4,7,12-16H2,(H,29,33);1-9,16-17H,10-15H2,(H,31,35);1-11,18H,12-17H2,(H,27,31);1-9,16-17H,10-15H2,(H,28,32);5-7,9-10,12-13,19,21H,3-4,8,11,14-18H2,1-2H3,(H,26,30);3-8,15-16H,9-14H2,1-2H3,(H,27,31);4-5,7-10,16H,2-3,6,11-15H2,1H3,(H,27,31);3-8,15-16H,9-14H2,1-2H3,(H,24,28);4-9,15H,2-3,10-14H2,1H3,(H,26,30)
InChIKeyGLBOLECJCLMVBC-UHFFFAOYSA-N
XLogP40.46
TPSA655.40 Ų
H-Bond Donors10
H-Bond Acceptors40
Rotatable Bonds66
Heavy Atoms326
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004701.11
LogP ≤ 540.46
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1040

Analyze 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide with MolForge

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Related Compounds

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CID 145475425
2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-ethylpiperazine-1-carbonyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(piperazine-1-carbonyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-4-yl)ethylamino]pyridine-3-carboxamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-(2,2,2-trifluoroethyl)benzene-1,4-dicarboxamide
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2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(2-amino-5-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[[4-amino-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one
CID 157952108
6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-butylpyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-pentylpyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-pentylpyridine-3-carboxamide;N-hexyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-(naphthalene-1-carbonyl)piperazin-1-yl]pyridine-3-carboxamide;N-(2-phenylethyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide
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2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carbonitrile;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(6-amino-2-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[[2-amino-5-(trifluoromethyl)pyrimidin-4-yl]amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one
CID 158275026
2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(6-amino-2-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[[2-amino-5-(trifluoromethyl)pyrimidin-4-yl]amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one
CID 158643222
2-amino-4-[[(1S)-1-(8-chloro-2-cyclopropyl-1-oxoisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-2-cyclopropyl-1-oxoisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(2-amino-5-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-cyclopropylisoquinolin-1-one;3-[(1S)-1-[(6-amino-2-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-cyclopropylisoquinolin-1-one;3-[(1S)-1-[[2-amino-5-(trifluoromethyl)pyrimidin-4-yl]amino]ethyl]-8-chloro-2-cyclopropylisoquinolin-1-one;3-[(1S)-1-[[4-amino-5-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]-8-chloro-2-cyclopropylisoquinolin-1-one
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2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(4-ethylpiperazine-1-carbonyl)benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(piperazine-1-carbonyl)benzamide;2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-(2,2,2-trifluoroethyl)benzene-1,4-dicarboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(3H-pyrrol-4-yl)ethylamino]pyridine-3-carboxamide
CID 158952233
2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(2-amino-5-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[[4-amino-5-(trifluoromethyl)pyrimidin-2-yl]amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one
CID 159030744
Lithium;4-bromo-3-(trifluoromethyl)benzamide;bis(carbon dioxide);2-(2-chloro-6-fluorophenyl)ethanamine;4-[6-[2-(2-chloro-6-fluorophenyl)ethylamino]-3-pyridinyl]-3-(trifluoromethyl)benzamide;[4-[6-[2-(2-chloro-6-fluorophenyl)ethylamino]-3-pyridinyl]-3-(trifluoromethyl)phenyl]-(4-ethylpiperidin-1-yl)methanone;[4-[6-[2-(2-chloro-6-fluorophenyl)ethylamino]-3-pyridinyl]-3-(trifluoromethyl)phenyl]-piperidin-1-ylmethanone;ethyl piperidine-4-carboxylate;(6-fluoro-3-pyridinyl)boronic acid;4-(6-fluoro-3-pyridinyl)-3-(trifluoromethyl)benzamide;hydroxide
CID 160020392
2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carbonitrile;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(6-amino-2-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[(2-amino-5-fluoropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[[2-amino-5-(trifluoromethyl)pyrimidin-4-yl]amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one
CID 160250857
2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(2-amino-5-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[(6-amino-2-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[[2-amino-5-(trifluoromethyl)pyrimidin-4-yl]amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one
CID 160554307

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide?
The IUPAC name of 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide (CID 158288517) is 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide is CC(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3Br)CC2)nc1.CC(C)CCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.CCC(CC)C(=O)N1CCN(c2ccc(C(=O)NCCCc3ccccc3)cn2)CC1.CCCCCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.CCCCNC(=O)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCCc1ccccc1)c1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Cl)CC2)nc1.O=C(NCCCc1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCc1cccc(Cl)c1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nc1.O=C(NCCc1ccccc1)c1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Cl)CC2)nc1.O=C(NCCc1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3Br)CC2)nc1.
What is the InChIKey of 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide?
The InChIKey is GLBOLECJCLMVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27F3N4O2.C26H26Cl2N4O2.C26H24ClF3N4O2.C25H25BrN4O2.C25H24Cl2N4O2.C25H34N4O2.2C23H27F3N4O2.C22H27BrN4O2.C22H25F3N4O2/c28-27(29,30)23-11-5-4-10-22(23)26(36)34-17-15-33(16-18-34)24-13-12-21(19-32-24)25(35)31-14-6-9-20-7-2-1-3-8-20;27-21-9-10-23(28)22(17-21)26(34)32-15-13-31(14-16-32)24-11-8-20(18-30-24)25(33)29-12-4-7-19-5-2-1-3-6-19;27-20-5-3-4-18(16-20)10-11-31-24(35)19-8-9-23(32-17-19)33-12-14-34(15-13-33)25(36)21-6-1-2-7-22(21)26(28,29)30;26-22-9-5-4-8-21(22)25(32)30-16-14-29(15-17-30)23-11-10-20(18-28-23)24(31)27-13-12-19-6-2-1-3-7-19;26-20-7-8-22(27)21(16-20)25(33)31-14-12-30(13-15-31)23-9-6-19(17-29-23)24(32)28-11-10-18-4-2-1-3-5-18;1-3-21(4-2)25(31)29-17-15-28(16-18-29)23-13-12-22(19-27-23)24(30)26-14-8-11-20-9-6-5-7-10-20;1-16(2)9-10-27-21(31)17-7-8-20(28-15-17)29-11-13-30(14-12-29)22(32)18-5-3-4-6-19(18)23(24,25)26;1-2-3-6-11-27-21(31)17-9-10-20(28-16-17)29-12-14-30(15-13-29)22(32)18-7-4-5-8-19(18)23(24,25)26;1-16(2)9-10-24-21(28)17-7-8-20(25-15-17)26-11-13-27(14-12-26)22(29)18-5-3-4-6-19(18)23;1-2-3-10-26-20(30)16-8-9-19(27-15-16)28-11-13-29(14-12-28)21(31)17-6-4-5-7-18(17)22(23,24)25/h1-5,7-8,10-13,19H,6,9,14-18H2,(H,31,35);1-3,5-6,8-11,17-18H,4,7,12-16H2,(H,29,33);1-9,16-17H,10-15H2,(H,31,35);1-11,18H,12-17H2,(H,27,31);1-9,16-17H,10-15H2,(H,28,32);5-7,9-10,12-13,19,21H,3-4,8,11,14-18H2,1-2H3,(H,26,30);3-8,15-16H,9-14H2,1-2H3,(H,27,31);4-5,7-10,16H,2-3,6,11-15H2,1H3,(H,27,31);3-8,15-16H,9-14H2,1-2H3,(H,24,28);4-9,15H,2-3,10-14H2,1H3,(H,26,30).
What are the key properties of 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide?
6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide has a molecular weight of 4701.11 g/mol, XLogP of 40.46, 66 rotatable bonds, 10 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide;6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;N-butyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-[2-(3-chlorophenyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(2-phenylethyl)pyridine-3-carboxamide;6-[4-(2,5-dichlorobenzoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;6-[4-(2-ethylbutanoyl)piperazin-1-yl]-N-(3-phenylpropyl)pyridine-3-carboxamide;N-(3-methylbutyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-pentyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide;N-(3-phenylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 158288517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).