N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide

C196H284Cl3F6N27O39S14 — CID 160832062

IUPACN-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide
SMILESCC(C)S(=O)(=O)NC1CCC(C(=O)NCCCN2CCOCC2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSCc2c(Cl)cccc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSCc2c(F)cccc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSc2cc(C(F)(F)F)nc3ccccc23)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2c3ccccc3nc3ccccc23)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cc(-c3ccco3)[nH]n2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccnc2Oc2ccc(F)cc2F)CC1.CCN(CCNC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1)c1ccccc1.COC(=O)c1scc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c1C(=O)OC.COc1ccc(CCNC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1OC
InChIInChI=1S/C23H27N3O3S.C22H28F3N3O3S2.C21H25F2N3O4S.C20H33N3O3S.C20H32N2O5S.C19H28Cl2N2O3S2.C19H28ClFN2O3S2.C18H26N2O7S2.C17H24N4O4S.C17H33N3O4S/c1-15(2)30(28,29)26-17-13-11-16(12-14-17)23(27)25-22-18-7-3-5-9-20(18)24-21-10-6-4-8-19(21)22;1-14(2)33(30,31)28-16-9-7-15(8-10-16)21(29)26-11-12-32-19-13-20(22(23,24)25)27-18-6-4-3-5-17(18)19;1-13(2)31(28,29)26-16-8-5-14(6-9-16)20(27)25-18-4-3-11-24-21(18)30-19-10-7-15(22)12-17(19)23;1-4-23(19-8-6-5-7-9-19)15-14-21-20(24)17-10-12-18(13-11-17)22-27(25,26)16(2)3;1-14(2)28(24,25)22-17-8-6-16(7-9-17)20(23)21-12-11-15-5-10-18(26-3)19(13-15)27-4;2*1-13(2)28(25,26)23-15-8-6-14(7-9-15)19(24)22-10-11-27-12-16-17(20)4-3-5-18(16)21;1-10(2)29(24,25)20-12-7-5-11(6-8-12)16(21)19-13-9-28-15(18(23)27-4)14(13)17(22)26-3;1-11(2)26(23,24)21-13-7-5-12(6-8-13)17(22)18-16-10-14(19-20-16)15-4-3-9-25-15;1-14(2)25(22,23)19-16-6-4-15(5-7-16)17(21)18-8-3-9-20-10-12-24-13-11-20/h3-10,15-17,26H,11-14H2,1-2H3,(H,24,25,27);3-6,13-16,28H,7-12H2,1-2H3,(H,26,29);3-4,7,10-14,16,26H,5-6,8-9H2,1-2H3,(H,25,27);5-9,16-18,22H,4,10-15H2,1-3H3,(H,21,24);5,10,13-14,16-17,22H,6-9,11-12H2,1-4H3,(H,21,23);2*3-5,13-15,23H,6-12H2,1-2H3,(H,22,24);9-12,20H,5-8H2,1-4H3,(H,19,21);3-4,9-13,21H,5-8H2,1-2H3,(H2,18,19,20,22);14-16,19H,3-13H2,1-2H3,(H,18,21)
InChIKeySGXQRMSGQBGXDZ-UHFFFAOYSA-N
MW4311.86 g/mol
LogP30.60
Rot. Bonds77

About N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide

N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide (PubChem CID 160832062) has the molecular formula C196H284Cl3F6N27O39S14 and a molecular weight of 4311.86 g/mol. Its IUPAC name is N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide
PubChem CID160832062
Molecular FormulaC196H284Cl3F6N27O39S14
Molecular Weight4311.86 g/mol
Exact Mass4306.61
IUPAC NameN-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide
SMILESCC(C)S(=O)(=O)NC1CCC(C(=O)NCCCN2CCOCC2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSCc2c(Cl)cccc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSCc2c(F)cccc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSc2cc(C(F)(F)F)nc3ccccc23)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2c3ccccc3nc3ccccc23)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cc(-c3ccco3)[nH]n2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccnc2Oc2ccc(F)cc2F)CC1.CCN(CCNC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1)c1ccccc1.COC(=O)c1scc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c1C(=O)OC.COc1ccc(CCNC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1OC
InChIInChI=1S/C23H27N3O3S.C22H28F3N3O3S2.C21H25F2N3O4S.C20H33N3O3S.C20H32N2O5S.C19H28Cl2N2O3S2.C19H28ClFN2O3S2.C18H26N2O7S2.C17H24N4O4S.C17H33N3O4S/c1-15(2)30(28,29)26-17-13-11-16(12-14-17)23(27)25-22-18-7-3-5-9-20(18)24-21-10-6-4-8-19(21)22;1-14(2)33(30,31)28-16-9-7-15(8-10-16)21(29)26-11-12-32-19-13-20(22(23,24)25)27-18-6-4-3-5-17(18)19;1-13(2)31(28,29)26-16-8-5-14(6-9-16)20(27)25-18-4-3-11-24-21(18)30-19-10-7-15(22)12-17(19)23;1-4-23(19-8-6-5-7-9-19)15-14-21-20(24)17-10-12-18(13-11-17)22-27(25,26)16(2)3;1-14(2)28(24,25)22-17-8-6-16(7-9-17)20(23)21-12-11-15-5-10-18(26-3)19(13-15)27-4;2*1-13(2)28(25,26)23-15-8-6-14(7-9-15)19(24)22-10-11-27-12-16-17(20)4-3-5-18(16)21;1-10(2)29(24,25)20-12-7-5-11(6-8-12)16(21)19-13-9-28-15(18(23)27-4)14(13)17(22)26-3;1-11(2)26(23,24)21-13-7-5-12(6-8-13)17(22)18-16-10-14(19-20-16)15-4-3-9-25-15;1-14(2)25(22,23)19-16-6-4-15(5-7-16)17(21)18-8-3-9-20-10-12-24-13-11-20/h3-10,15-17,26H,11-14H2,1-2H3,(H,24,25,27);3-6,13-16,28H,7-12H2,1-2H3,(H,26,29);3-4,7,10-14,16,26H,5-6,8-9H2,1-2H3,(H,25,27);5-9,16-18,22H,4,10-15H2,1-3H3,(H,21,24);5,10,13-14,16-17,22H,6-9,11-12H2,1-4H3,(H,21,23);2*3-5,13-15,23H,6-12H2,1-2H3,(H,22,24);9-12,20H,5-8H2,1-4H3,(H,19,21);3-4,9-13,21H,5-8H2,1-2H3,(H2,18,19,20,22);14-16,19H,3-13H2,1-2H3,(H,18,21)
InChIKeySGXQRMSGQBGXDZ-UHFFFAOYSA-N
XLogP30.60
TPSA929.19 Ų
H-Bond Donors21
H-Bond Acceptors49
Rotatable Bonds77
Heavy Atoms285
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004311.86
LogP ≤ 530.60
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1049

Analyze N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide?
The IUPAC name of N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide (CID 160832062) is N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide?
The canonical SMILES for N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide is CC(C)S(=O)(=O)NC1CCC(C(=O)NCCCN2CCOCC2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSCc2c(Cl)cccc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSCc2c(F)cccc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)NCCSc2cc(C(F)(F)F)nc3ccccc23)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2c3ccccc3nc3ccccc23)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cc(-c3ccco3)[nH]n2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccnc2Oc2ccc(F)cc2F)CC1.CCN(CCNC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1)c1ccccc1.COC(=O)c1scc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c1C(=O)OC.COc1ccc(CCNC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1OC.
What is the InChIKey of N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide?
The InChIKey is SGXQRMSGQBGXDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O3S.C22H28F3N3O3S2.C21H25F2N3O4S.C20H33N3O3S.C20H32N2O5S.C19H28Cl2N2O3S2.C19H28ClFN2O3S2.C18H26N2O7S2.C17H24N4O4S.C17H33N3O4S/c1-15(2)30(28,29)26-17-13-11-16(12-14-17)23(27)25-22-18-7-3-5-9-20(18)24-21-10-6-4-8-19(21)22;1-14(2)33(30,31)28-16-9-7-15(8-10-16)21(29)26-11-12-32-19-13-20(22(23,24)25)27-18-6-4-3-5-17(18)19;1-13(2)31(28,29)26-16-8-5-14(6-9-16)20(27)25-18-4-3-11-24-21(18)30-19-10-7-15(22)12-17(19)23;1-4-23(19-8-6-5-7-9-19)15-14-21-20(24)17-10-12-18(13-11-17)22-27(25,26)16(2)3;1-14(2)28(24,25)22-17-8-6-16(7-9-17)20(23)21-12-11-15-5-10-18(26-3)19(13-15)27-4;2*1-13(2)28(25,26)23-15-8-6-14(7-9-15)19(24)22-10-11-27-12-16-17(20)4-3-5-18(16)21;1-10(2)29(24,25)20-12-7-5-11(6-8-12)16(21)19-13-9-28-15(18(23)27-4)14(13)17(22)26-3;1-11(2)26(23,24)21-13-7-5-12(6-8-13)17(22)18-16-10-14(19-20-16)15-4-3-9-25-15;1-14(2)25(22,23)19-16-6-4-15(5-7-16)17(21)18-8-3-9-20-10-12-24-13-11-20/h3-10,15-17,26H,11-14H2,1-2H3,(H,24,25,27);3-6,13-16,28H,7-12H2,1-2H3,(H,26,29);3-4,7,10-14,16,26H,5-6,8-9H2,1-2H3,(H,25,27);5-9,16-18,22H,4,10-15H2,1-3H3,(H,21,24);5,10,13-14,16-17,22H,6-9,11-12H2,1-4H3,(H,21,23);2*3-5,13-15,23H,6-12H2,1-2H3,(H,22,24);9-12,20H,5-8H2,1-4H3,(H,19,21);3-4,9-13,21H,5-8H2,1-2H3,(H2,18,19,20,22);14-16,19H,3-13H2,1-2H3,(H,18,21).
What are the key properties of N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide?
N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide has a molecular weight of 4311.86 g/mol, XLogP of 30.60, 77 rotatable bonds, 21 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for N-acridin-9-yl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2,6-dichlorophenyl)methylsulfanyl]ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(2,4-difluorophenoxy)-3-pyridinyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;dimethyl 4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]thiophene-2,3-dicarboxylate;N-[2-(N-ethylanilino)ethyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[5-(furan-2-yl)-1H-pyrazol-3-yl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3-morpholin-4-ylpropyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-[2-[2-(trifluoromethyl)quinolin-4-yl]sulfanylethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 160832062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).