N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide

C200H298Cl5F11N26O38S10 — CID 161155730

IUPACN-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide
SMILESCC(C)S(=O)(=O)NC1CCC(C(=O)Nc2c(F)c(F)c(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2F)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(Cl)cc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(F)c(F)c2F)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(F)cc2N2C[C@@H](C)O[C@@H](C)C2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(Cl)c2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2F)CC1.CC1C[C@H](C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2F)CC[C@H]1NS(=O)(=O)C(C)C.COc1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1OC.Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)ccc1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1
InChIInChI=1S/C23H36FN3O4S.C23H37N3O4S.C22H34ClN3O4S.C22H31F4N3O4S.C22H33F2N3O4S.C22H34FN3O4S.C18H28N2O5S.2C16H22Cl2N2O3S.C16H21F3N2O3S/c1-14(2)32(29,30)26-21-8-6-18(10-15(21)3)23(28)25-22-9-7-19(11-20(22)24)27-12-16(4)31-17(5)13-27;1-15(2)31(28,29)25-20-8-6-19(7-9-20)23(27)24-22-11-10-21(12-16(22)3)26-13-17(4)30-18(5)14-26;1-14(2)31(28,29)25-18-7-5-17(6-8-18)22(27)24-19-9-10-21(20(23)11-19)26-12-15(3)30-16(4)13-26;1-11(2)34(31,32)28-15-7-5-14(6-8-15)22(30)27-20-16(23)18(25)21(19(26)17(20)24)29-9-12(3)33-13(4)10-29;1-13(2)32(29,30)26-17-7-5-16(6-8-17)22(28)25-18-9-10-19(21(24)20(18)23)27-11-14(3)31-15(4)12-27;1-14(2)31(28,29)25-19-8-5-17(6-9-19)22(27)24-20-10-7-18(23)11-21(20)26-12-15(3)30-16(4)13-26;1-12(2)26(22,23)20-14-7-5-13(6-8-14)18(21)19-15-9-10-16(24-3)17(11-15)25-4;1-10(2)24(22,23)20-13-6-3-11(4-7-13)16(21)19-15-8-5-12(17)9-14(15)18;1-10(2)24(22,23)20-12-5-3-11(4-6-12)16(21)19-13-7-8-14(17)15(18)9-13;1-9(2)25(23,24)21-11-5-3-10(4-6-11)16(22)20-13-8-7-12(17)14(18)15(13)19/h7,9,11,14-18,21,26H,6,8,10,12-13H2,1-5H3,(H,25,28);10-12,15,17-20,25H,6-9,13-14H2,1-5H3,(H,24,27);9-11,14-18,25H,5-8,12-13H2,1-4H3,(H,24,27);11-15,28H,5-10H2,1-4H3,(H,27,30);9-10,13-17,26H,5-8,11-12H2,1-4H3,(H,25,28);7,10-11,14-17,19,25H,5-6,8-9,12-13H2,1-4H3,(H,24,27);9-14,20H,5-8H2,1-4H3,(H,19,21);5,8-11,13,20H,3-4,6-7H2,1-2H3,(H,19,21);7-12,20H,3-6H2,1-2H3,(H,19,21);7-11,21H,3-6H2,1-2H3,(H,20,22)/t15?,16-,17+,18-,21-;17-,18+,19?,20?;15-,16+,17?,18?;12-,13+,14?,15?;14-,15+,16?,17?;15-,16+,17?,19?;;;;/m1........./s1
InChIKeyUPGPBUKJNYWRSI-SEJXVJMASA-N
MW4381.64 g/mol
LogP34.17
Rot. Bonds58

About N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide

N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide (PubChem CID 161155730) has the molecular formula C200H298Cl5F11N26O38S10 and a molecular weight of 4381.64 g/mol. Its IUPAC name is N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide
PubChem CID161155730
Molecular FormulaC200H298Cl5F11N26O38S10
Molecular Weight4381.64 g/mol
Exact Mass4375.77
IUPAC NameN-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide
SMILESCC(C)S(=O)(=O)NC1CCC(C(=O)Nc2c(F)c(F)c(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2F)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(Cl)cc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(F)c(F)c2F)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(F)cc2N2C[C@@H](C)O[C@@H](C)C2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(Cl)c2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2F)CC1.CC1C[C@H](C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2F)CC[C@H]1NS(=O)(=O)C(C)C.COc1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1OC.Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)ccc1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1
InChIInChI=1S/C23H36FN3O4S.C23H37N3O4S.C22H34ClN3O4S.C22H31F4N3O4S.C22H33F2N3O4S.C22H34FN3O4S.C18H28N2O5S.2C16H22Cl2N2O3S.C16H21F3N2O3S/c1-14(2)32(29,30)26-21-8-6-18(10-15(21)3)23(28)25-22-9-7-19(11-20(22)24)27-12-16(4)31-17(5)13-27;1-15(2)31(28,29)25-20-8-6-19(7-9-20)23(27)24-22-11-10-21(12-16(22)3)26-13-17(4)30-18(5)14-26;1-14(2)31(28,29)25-18-7-5-17(6-8-18)22(27)24-19-9-10-21(20(23)11-19)26-12-15(3)30-16(4)13-26;1-11(2)34(31,32)28-15-7-5-14(6-8-15)22(30)27-20-16(23)18(25)21(19(26)17(20)24)29-9-12(3)33-13(4)10-29;1-13(2)32(29,30)26-17-7-5-16(6-8-17)22(28)25-18-9-10-19(21(24)20(18)23)27-11-14(3)31-15(4)12-27;1-14(2)31(28,29)25-19-8-5-17(6-9-19)22(27)24-20-10-7-18(23)11-21(20)26-12-15(3)30-16(4)13-26;1-12(2)26(22,23)20-14-7-5-13(6-8-14)18(21)19-15-9-10-16(24-3)17(11-15)25-4;1-10(2)24(22,23)20-13-6-3-11(4-7-13)16(21)19-15-8-5-12(17)9-14(15)18;1-10(2)24(22,23)20-12-5-3-11(4-6-12)16(21)19-13-7-8-14(17)15(18)9-13;1-9(2)25(23,24)21-11-5-3-10(4-6-11)16(22)20-13-8-7-12(17)14(18)15(13)19/h7,9,11,14-18,21,26H,6,8,10,12-13H2,1-5H3,(H,25,28);10-12,15,17-20,25H,6-9,13-14H2,1-5H3,(H,24,27);9-11,14-18,25H,5-8,12-13H2,1-4H3,(H,24,27);11-15,28H,5-10H2,1-4H3,(H,27,30);9-10,13-17,26H,5-8,11-12H2,1-4H3,(H,25,28);7,10-11,14-17,19,25H,5-6,8-9,12-13H2,1-4H3,(H,24,27);9-14,20H,5-8H2,1-4H3,(H,19,21);5,8-11,13,20H,3-4,6-7H2,1-2H3,(H,19,21);7-12,20H,3-6H2,1-2H3,(H,19,21);7-11,21H,3-6H2,1-2H3,(H,20,22)/t15?,16-,17+,18-,21-;17-,18+,19?,20?;15-,16+,17?,18?;12-,13+,14?,15?;14-,15+,16?,17?;15-,16+,17?,19?;;;;/m1........./s1
InChIKeyUPGPBUKJNYWRSI-SEJXVJMASA-N
XLogP34.17
TPSA845.98 Ų
H-Bond Donors20
H-Bond Acceptors44
Rotatable Bonds58
Heavy Atoms290
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004381.64
LogP ≤ 534.17
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1044

Analyze N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide?
The IUPAC name of N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide (CID 161155730) is N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide.
What is the SMILES notation for N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide?
The canonical SMILES for N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide is CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2c(F)c(F)c(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2F)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(Cl)cc2Cl)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(F)c(F)c2F)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(F)cc2N2C[C@@H](C)O[C@@H](C)C2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(Cl)c2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)c(F)c2F)CC1.CC1C[C@H](C(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2F)CC[C@H]1NS(=O)(=O)C(C)C.COc1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1OC.Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)ccc1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1.
What is the InChIKey of N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide?
The InChIKey is UPGPBUKJNYWRSI-SEJXVJMASA-N. The full InChI is InChI=1S/C23H36FN3O4S.C23H37N3O4S.C22H34ClN3O4S.C22H31F4N3O4S.C22H33F2N3O4S.C22H34FN3O4S.C18H28N2O5S.2C16H22Cl2N2O3S.C16H21F3N2O3S/c1-14(2)32(29,30)26-21-8-6-18(10-15(21)3)23(28)25-22-9-7-19(11-20(22)24)27-12-16(4)31-17(5)13-27;1-15(2)31(28,29)25-20-8-6-19(7-9-20)23(27)24-22-11-10-21(12-16(22)3)26-13-17(4)30-18(5)14-26;1-14(2)31(28,29)25-18-7-5-17(6-8-18)22(27)24-19-9-10-21(20(23)11-19)26-12-15(3)30-16(4)13-26;1-11(2)34(31,32)28-15-7-5-14(6-8-15)22(30)27-20-16(23)18(25)21(19(26)17(20)24)29-9-12(3)33-13(4)10-29;1-13(2)32(29,30)26-17-7-5-16(6-8-17)22(28)25-18-9-10-19(21(24)20(18)23)27-11-14(3)31-15(4)12-27;1-14(2)31(28,29)25-19-8-5-17(6-9-19)22(27)24-20-10-7-18(23)11-21(20)26-12-15(3)30-16(4)13-26;1-12(2)26(22,23)20-14-7-5-13(6-8-14)18(21)19-15-9-10-16(24-3)17(11-15)25-4;1-10(2)24(22,23)20-13-6-3-11(4-7-13)16(21)19-15-8-5-12(17)9-14(15)18;1-10(2)24(22,23)20-12-5-3-11(4-6-12)16(21)19-13-7-8-14(17)15(18)9-13;1-9(2)25(23,24)21-11-5-3-10(4-6-11)16(22)20-13-8-7-12(17)14(18)15(13)19/h7,9,11,14-18,21,26H,6,8,10,12-13H2,1-5H3,(H,25,28);10-12,15,17-20,25H,6-9,13-14H2,1-5H3,(H,24,27);9-11,14-18,25H,5-8,12-13H2,1-4H3,(H,24,27);11-15,28H,5-10H2,1-4H3,(H,27,30);9-10,13-17,26H,5-8,11-12H2,1-4H3,(H,25,28);7,10-11,14-17,19,25H,5-6,8-9,12-13H2,1-4H3,(H,24,27);9-14,20H,5-8H2,1-4H3,(H,19,21);5,8-11,13,20H,3-4,6-7H2,1-2H3,(H,19,21);7-12,20H,3-6H2,1-2H3,(H,19,21);7-11,21H,3-6H2,1-2H3,(H,20,22)/t15?,16-,17+,18-,21-;17-,18+,19?,20?;15-,16+,17?,18?;12-,13+,14?,15?;14-,15+,16?,17?;15-,16+,17?,19?;;;;/m1........./s1.
What are the key properties of N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide?
N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide has a molecular weight of 4381.64 g/mol, XLogP of 34.17, 58 rotatable bonds, 20 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(2,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dichlorophenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-(3,4-dimethoxyphenyl)-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3-difluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-fluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2,3,5,6-tetrafluorophenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;4-(propan-2-ylsulfonylamino)-N-(2,3,4-trifluorophenyl)cyclohexane-1-carboxamide;trans-(1R,4R)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-fluorophenyl]-3-methyl-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide is sourced from PubChem (CID 161155730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).