N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine

C357H571ClF4N40O15S — CID 167574307

IUPACN'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine
SMILESCC(=O)NC(CNC(C)C)C(C)C.CC(C)C1CN(C(C)C)C1=O.CC(C)C1CN(C(C)C)CCN1C(=O)OCc1ccccc1.CC(C)CC(=O)N(Cc1ccccc1)C(C)C.CC(C)CCN(C(=O)c1ccccc1)C(C)C.CC(C)CCN(Cc1ccccc1)C(C)C.CC(C)CN(Cc1ccccc1)C(C)C.CC(C)NCC(NC(=O)OC(C)(C)C)C(C)C.CC(C)NCC(NC(=O)OCc1ccccc1)C(C)C.CC(C)NCC(NC(=O)c1ccccc1)C(C)C.CC(C)NCCN(Cc1ccccc1)C(C)C.CC(C)Nc1ccc(-c2ccccc2)cc1C(C)C.CC(C)Nc1cccc(C(C)C)c1.CC(C)Nc1cccc(C(F)(F)F)c1C(C)C.CC(C)Nc1ccccc1C(C)C.CC(C)Nc1cccnc1C(C)C.CC(C)Nc1nccc(-c2ccccc2)c1C(C)C.CC(C)Nc1nccc(Cl)c1C(C)C.CC(C)Nc1ncccc1C(C)C.CC(C)Nc1nnccc1C(C)C.CC(C)c1cc(C(C)C)c(F)cn1.CC(C)c1ccc(C(C)C)s1.CC(C)c1ccc(NC(=O)c2ccccc2)c(C(C)C)c1.CC(C)c1cccc(C(C)C)n1.CC(C)c1ccnc(C(C)C)c1.CCOC(=O)N1CCN(C(C)C)CC1C(C)C.COc1ccnc(NC(C)C)c1C(C)C
InChIInChI=1S/C19H23NO.C18H28N2O2.C18H23N.C17H22N2.C16H26N2O2.C15H24N2O.C15H26N2.2C15H23NO.C15H25N.C14H23N.C13H18F3N.C13H26N2O2.C13H28N2O2.C12H20N2O.2C12H19N.C11H17ClN2.C11H16FN.2C11H18N2.2C11H17N.C10H17N3.C10H22N2O.C10H16S.C9H17NO/c1-13(2)16-10-11-18(17(12-16)14(3)4)20-19(21)15-8-6-5-7-9-15;1-14(2)17-12-19(15(3)4)10-11-20(17)18(21)22-13-16-8-6-5-7-9-16;1-13(2)17-12-16(15-8-6-5-7-9-15)10-11-18(17)19-14(3)4;1-12(2)16-15(14-8-6-5-7-9-14)10-11-18-17(16)19-13(3)4;1-12(2)15(10-17-13(3)4)18-16(19)20-11-14-8-6-5-7-9-14;1-11(2)14(10-16-12(3)4)17-15(18)13-8-6-5-7-9-13;1-13(2)16-10-11-17(14(3)4)12-15-8-6-5-7-9-15;1-12(2)10-15(17)16(13(3)4)11-14-8-6-5-7-9-14;1-12(2)10-11-16(13(3)4)15(17)14-8-6-5-7-9-14;1-13(2)10-11-16(14(3)4)12-15-8-6-5-7-9-15;1-12(2)10-15(13(3)4)11-14-8-6-5-7-9-14;1-8(2)12-10(13(14,15)16)6-5-7-11(12)17-9(3)4;1-6-17-13(16)15-8-7-14(11(4)5)9-12(15)10(2)3;1-9(2)11(8-14-10(3)4)15-12(16)17-13(5,6)7;1-8(2)11-10(15-5)6-7-13-12(11)14-9(3)4;1-9(2)11-6-5-7-12(8-11)13-10(3)4;1-9(2)11-7-5-6-8-12(11)13-10(3)4;1-7(2)10-9(12)5-6-13-11(10)14-8(3)4;1-7(2)9-5-11(8(3)4)13-6-10(9)12;1-8(2)11-10(13-9(3)4)6-5-7-12-11;1-8(2)10-6-5-7-12-11(10)13-9(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;1-7(2)9-5-6-11-13-10(9)12-8(3)4;1-7(2)10(12-9(5)13)6-11-8(3)4;1-7(2)9-5-6-10(11-9)8(3)4;1-6(2)8-5-10(7(3)4)9(8)11/h5-14H,1-4H3,(H,20,21);5-9,14-15,17H,10-13H2,1-4H3;5-14,19H,1-4H3;5-13H,1-4H3,(H,18,19);5-9,12-13,15,17H,10-11H2,1-4H3,(H,18,19);5-9,11-12,14,16H,10H2,1-4H3,(H,17,18);5-9,13-14,16H,10-12H2,1-4H3;2*5-9,12-13H,10-11H2,1-4H3;5-9,13-14H,10-12H2,1-4H3;5-9,12-13H,10-11H2,1-4H3;5-9,17H,1-4H3;10-12H,6-9H2,1-5H3;9-11,14H,8H2,1-7H3,(H,15,16);6-9H,1-5H3,(H,13,14);2*5-10,13H,1-4H3;5-8H,1-4H3,(H,13,14);5-8H,1-4H3;5-9,13H,1-4H3;5-9H,1-4H3,(H,12,13);2*5-9H,1-4H3;5-8H,1-4H3,(H,12,13);7-8,10-11H,6H2,1-5H3,(H,12,13);5-8H,1-4H3;6-8H,5H2,1-4H3
InChIKeyGHYHRORDFTYEMN-UHFFFAOYSA-N
MW5807.27 g/mol
LogP89.96
Rot. Bonds105

About N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine

N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine (PubChem CID 167574307) has the molecular formula C357H571ClF4N40O15S and a molecular weight of 5807.27 g/mol. Its IUPAC name is N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine.

Molecular Properties

Compound NameN'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine
PubChem CID167574307
Molecular FormulaC357H571ClF4N40O15S
Molecular Weight5807.27 g/mol
Exact Mass5802.45
IUPAC NameN'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine
SMILESCC(=O)NC(CNC(C)C)C(C)C.CC(C)C1CN(C(C)C)C1=O.CC(C)C1CN(C(C)C)CCN1C(=O)OCc1ccccc1.CC(C)CC(=O)N(Cc1ccccc1)C(C)C.CC(C)CCN(C(=O)c1ccccc1)C(C)C.CC(C)CCN(Cc1ccccc1)C(C)C.CC(C)CN(Cc1ccccc1)C(C)C.CC(C)NCC(NC(=O)OC(C)(C)C)C(C)C.CC(C)NCC(NC(=O)OCc1ccccc1)C(C)C.CC(C)NCC(NC(=O)c1ccccc1)C(C)C.CC(C)NCCN(Cc1ccccc1)C(C)C.CC(C)Nc1ccc(-c2ccccc2)cc1C(C)C.CC(C)Nc1cccc(C(C)C)c1.CC(C)Nc1cccc(C(F)(F)F)c1C(C)C.CC(C)Nc1ccccc1C(C)C.CC(C)Nc1cccnc1C(C)C.CC(C)Nc1nccc(-c2ccccc2)c1C(C)C.CC(C)Nc1nccc(Cl)c1C(C)C.CC(C)Nc1ncccc1C(C)C.CC(C)Nc1nnccc1C(C)C.CC(C)c1cc(C(C)C)c(F)cn1.CC(C)c1ccc(C(C)C)s1.CC(C)c1ccc(NC(=O)c2ccccc2)c(C(C)C)c1.CC(C)c1cccc(C(C)C)n1.CC(C)c1ccnc(C(C)C)c1.CCOC(=O)N1CCN(C(C)C)CC1C(C)C.COc1ccnc(NC(C)C)c1C(C)C
InChIInChI=1S/C19H23NO.C18H28N2O2.C18H23N.C17H22N2.C16H26N2O2.C15H24N2O.C15H26N2.2C15H23NO.C15H25N.C14H23N.C13H18F3N.C13H26N2O2.C13H28N2O2.C12H20N2O.2C12H19N.C11H17ClN2.C11H16FN.2C11H18N2.2C11H17N.C10H17N3.C10H22N2O.C10H16S.C9H17NO/c1-13(2)16-10-11-18(17(12-16)14(3)4)20-19(21)15-8-6-5-7-9-15;1-14(2)17-12-19(15(3)4)10-11-20(17)18(21)22-13-16-8-6-5-7-9-16;1-13(2)17-12-16(15-8-6-5-7-9-15)10-11-18(17)19-14(3)4;1-12(2)16-15(14-8-6-5-7-9-14)10-11-18-17(16)19-13(3)4;1-12(2)15(10-17-13(3)4)18-16(19)20-11-14-8-6-5-7-9-14;1-11(2)14(10-16-12(3)4)17-15(18)13-8-6-5-7-9-13;1-13(2)16-10-11-17(14(3)4)12-15-8-6-5-7-9-15;1-12(2)10-15(17)16(13(3)4)11-14-8-6-5-7-9-14;1-12(2)10-11-16(13(3)4)15(17)14-8-6-5-7-9-14;1-13(2)10-11-16(14(3)4)12-15-8-6-5-7-9-15;1-12(2)10-15(13(3)4)11-14-8-6-5-7-9-14;1-8(2)12-10(13(14,15)16)6-5-7-11(12)17-9(3)4;1-6-17-13(16)15-8-7-14(11(4)5)9-12(15)10(2)3;1-9(2)11(8-14-10(3)4)15-12(16)17-13(5,6)7;1-8(2)11-10(15-5)6-7-13-12(11)14-9(3)4;1-9(2)11-6-5-7-12(8-11)13-10(3)4;1-9(2)11-7-5-6-8-12(11)13-10(3)4;1-7(2)10-9(12)5-6-13-11(10)14-8(3)4;1-7(2)9-5-11(8(3)4)13-6-10(9)12;1-8(2)11-10(13-9(3)4)6-5-7-12-11;1-8(2)10-6-5-7-12-11(10)13-9(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;1-7(2)9-5-6-11-13-10(9)12-8(3)4;1-7(2)10(12-9(5)13)6-11-8(3)4;1-7(2)9-5-6-10(11-9)8(3)4;1-6(2)8-5-10(7(3)4)9(8)11/h5-14H,1-4H3,(H,20,21);5-9,14-15,17H,10-13H2,1-4H3;5-14,19H,1-4H3;5-13H,1-4H3,(H,18,19);5-9,12-13,15,17H,10-11H2,1-4H3,(H,18,19);5-9,11-12,14,16H,10H2,1-4H3,(H,17,18);5-9,13-14,16H,10-12H2,1-4H3;2*5-9,12-13H,10-11H2,1-4H3;5-9,13-14H,10-12H2,1-4H3;5-9,12-13H,10-11H2,1-4H3;5-9,17H,1-4H3;10-12H,6-9H2,1-5H3;9-11,14H,8H2,1-7H3,(H,15,16);6-9H,1-5H3,(H,13,14);2*5-10,13H,1-4H3;5-8H,1-4H3,(H,13,14);5-8H,1-4H3;5-9,13H,1-4H3;5-9H,1-4H3,(H,12,13);2*5-9H,1-4H3;5-8H,1-4H3,(H,12,13);7-8,10-11H,6H2,1-5H3,(H,12,13);5-8H,1-4H3;6-8H,5H2,1-4H3
InChIKeyGHYHRORDFTYEMN-UHFFFAOYSA-N
XLogP89.96
TPSA618.75 Ų
H-Bond Donors20
H-Bond Acceptors46
Rotatable Bonds105
Heavy Atoms418
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005807.27
LogP ≤ 589.96
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1046

Analyze N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine?
The IUPAC name of N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine (CID 167574307) is N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine.
What is the SMILES notation for N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine?
The canonical SMILES for N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine is CC(=O)NC(CNC(C)C)C(C)C.CC(C)C1CN(C(C)C)C1=O.CC(C)C1CN(C(C)C)CCN1C(=O)OCc1ccccc1.CC(C)CC(=O)N(Cc1ccccc1)C(C)C.CC(C)CCN(C(=O)c1ccccc1)C(C)C.CC(C)CCN(Cc1ccccc1)C(C)C.CC(C)CN(Cc1ccccc1)C(C)C.CC(C)NCC(NC(=O)OC(C)(C)C)C(C)C.CC(C)NCC(NC(=O)OCc1ccccc1)C(C)C.CC(C)NCC(NC(=O)c1ccccc1)C(C)C.CC(C)NCCN(Cc1ccccc1)C(C)C.CC(C)Nc1ccc(-c2ccccc2)cc1C(C)C.CC(C)Nc1cccc(C(C)C)c1.CC(C)Nc1cccc(C(F)(F)F)c1C(C)C.CC(C)Nc1ccccc1C(C)C.CC(C)Nc1cccnc1C(C)C.CC(C)Nc1nccc(-c2ccccc2)c1C(C)C.CC(C)Nc1nccc(Cl)c1C(C)C.CC(C)Nc1ncccc1C(C)C.CC(C)Nc1nnccc1C(C)C.CC(C)c1cc(C(C)C)c(F)cn1.CC(C)c1ccc(C(C)C)s1.CC(C)c1ccc(NC(=O)c2ccccc2)c(C(C)C)c1.CC(C)c1cccc(C(C)C)n1.CC(C)c1ccnc(C(C)C)c1.CCOC(=O)N1CCN(C(C)C)CC1C(C)C.COc1ccnc(NC(C)C)c1C(C)C.
What is the InChIKey of N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine?
The InChIKey is GHYHRORDFTYEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO.C18H28N2O2.C18H23N.C17H22N2.C16H26N2O2.C15H24N2O.C15H26N2.2C15H23NO.C15H25N.C14H23N.C13H18F3N.C13H26N2O2.C13H28N2O2.C12H20N2O.2C12H19N.C11H17ClN2.C11H16FN.2C11H18N2.2C11H17N.C10H17N3.C10H22N2O.C10H16S.C9H17NO/c1-13(2)16-10-11-18(17(12-16)14(3)4)20-19(21)15-8-6-5-7-9-15;1-14(2)17-12-19(15(3)4)10-11-20(17)18(21)22-13-16-8-6-5-7-9-16;1-13(2)17-12-16(15-8-6-5-7-9-15)10-11-18(17)19-14(3)4;1-12(2)16-15(14-8-6-5-7-9-14)10-11-18-17(16)19-13(3)4;1-12(2)15(10-17-13(3)4)18-16(19)20-11-14-8-6-5-7-9-14;1-11(2)14(10-16-12(3)4)17-15(18)13-8-6-5-7-9-13;1-13(2)16-10-11-17(14(3)4)12-15-8-6-5-7-9-15;1-12(2)10-15(17)16(13(3)4)11-14-8-6-5-7-9-14;1-12(2)10-11-16(13(3)4)15(17)14-8-6-5-7-9-14;1-13(2)10-11-16(14(3)4)12-15-8-6-5-7-9-15;1-12(2)10-15(13(3)4)11-14-8-6-5-7-9-14;1-8(2)12-10(13(14,15)16)6-5-7-11(12)17-9(3)4;1-6-17-13(16)15-8-7-14(11(4)5)9-12(15)10(2)3;1-9(2)11(8-14-10(3)4)15-12(16)17-13(5,6)7;1-8(2)11-10(15-5)6-7-13-12(11)14-9(3)4;1-9(2)11-6-5-7-12(8-11)13-10(3)4;1-9(2)11-7-5-6-8-12(11)13-10(3)4;1-7(2)10-9(12)5-6-13-11(10)14-8(3)4;1-7(2)9-5-11(8(3)4)13-6-10(9)12;1-8(2)11-10(13-9(3)4)6-5-7-12-11;1-8(2)10-6-5-7-12-11(10)13-9(3)4;1-8(2)10-5-6-12-11(7-10)9(3)4;1-8(2)10-6-5-7-11(12-10)9(3)4;1-7(2)9-5-6-11-13-10(9)12-8(3)4;1-7(2)10(12-9(5)13)6-11-8(3)4;1-7(2)9-5-6-10(11-9)8(3)4;1-6(2)8-5-10(7(3)4)9(8)11/h5-14H,1-4H3,(H,20,21);5-9,14-15,17H,10-13H2,1-4H3;5-14,19H,1-4H3;5-13H,1-4H3,(H,18,19);5-9,12-13,15,17H,10-11H2,1-4H3,(H,18,19);5-9,11-12,14,16H,10H2,1-4H3,(H,17,18);5-9,13-14,16H,10-12H2,1-4H3;2*5-9,12-13H,10-11H2,1-4H3;5-9,13-14H,10-12H2,1-4H3;5-9,12-13H,10-11H2,1-4H3;5-9,17H,1-4H3;10-12H,6-9H2,1-5H3;9-11,14H,8H2,1-7H3,(H,15,16);6-9H,1-5H3,(H,13,14);2*5-10,13H,1-4H3;5-8H,1-4H3,(H,13,14);5-8H,1-4H3;5-9,13H,1-4H3;5-9H,1-4H3,(H,12,13);2*5-9H,1-4H3;5-8H,1-4H3,(H,12,13);7-8,10-11H,6H2,1-5H3,(H,12,13);5-8H,1-4H3;6-8H,5H2,1-4H3.
What are the key properties of N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine?
N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine has a molecular weight of 5807.27 g/mol, XLogP of 89.96, 105 rotatable bonds, 20 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N,N'-di(propan-2-yl)ethane-1,2-diamine;benzyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;benzyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;N-benzyl-3-methyl-N-propan-2-ylbutanamide;N-benzyl-3-methyl-N-propan-2-ylbutan-1-amine;N-benzyl-2-methyl-N-propan-2-ylpropan-1-amine;tert-butyl N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]carbamate;4-chloro-N,3-di(propan-2-yl)pyridin-2-amine;N,2-di(propan-2-yl)aniline;N,3-di(propan-2-yl)aniline;1,3-di(propan-2-yl)azetidin-2-one;N-[2,4-di(propan-2-yl)phenyl]benzamide;N,4-di(propan-2-yl)pyridazin-3-amine;N,2-di(propan-2-yl)pyridin-3-amine;N,3-di(propan-2-yl)pyridin-2-amine;2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;2,5-di(propan-2-yl)thiophene;N,2-di(propan-2-yl)-3-(trifluoromethyl)aniline;ethyl 2,4-di(propan-2-yl)piperazine-1-carboxylate;5-fluoro-2,4-di(propan-2-yl)pyridine;4-methoxy-N,3-di(propan-2-yl)pyridin-2-amine;N-(3-methylbutyl)-N-propan-2-ylbenzamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]acetamide;N-[3-methyl-1-(propan-2-ylamino)butan-2-yl]benzamide;4-phenyl-N,2-di(propan-2-yl)aniline;4-phenyl-N,3-di(propan-2-yl)pyridin-2-amine is sourced from PubChem (CID 167574307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).