tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde

C256H385BCl2F3K4N43NaO24P — CID 159773421

IUPACtetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde
SMILESC1CN(CC2CC2)CCN1.CC(=O)OB(OC(C)=O)OC(C)=O.CC(C)(C)OC(=O)N1CCN(CC2CC2)CC1.CC(C)(C)OC(=O)N1CCNCC1.CPC.NC1CCC(N2CCN(CC3CC3)CC2)CC1.NC1CCC(N2CCN(CC3CC3)CC2)CC1.NC1CCC(O)CC1.O=C1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1.O=C1NCC2(CCCCC2)n2c1cc1cnc(Cl)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(Cl)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(NC3CCC(N4CCN(CC5CC5)CC4)CC3)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(NC3CCC(N4CCN(CC5CC5)CC4)CC3)nc12.O=CC(F)(F)F.O=CO[O-].O=CO[O-].OC1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1.[H-].[H-].[H-].[K+].[K+].[K+].[K+].[Na+].c1ccc(CN(Cc2ccccc2)C2CCC(N3CCN(CC4CC4)CC3)CC2)cc1.c1ccc(CN(Cc2ccccc2)C2CCC(N3CCN(CC4CC4)CC3)CC2)cc1
InChIInChI=1S/2C28H41N7O.2C28H39N3.C20H25NO.C20H23NO.2C14H15ClN4O.2C14H27N3.C13H24N2O2.C9H18N2O2.C8H16N2.C6H9BO6.C6H13NO.C2HF3O.C2H7P.2CH2O3.4K.Na.3H/c2*36-26-24-16-21-17-29-27(32-25(21)35(24)28(19-30-26)10-2-1-3-11-28)31-22-6-8-23(9-7-22)34-14-12-33(13-15-34)18-20-4-5-20;2*1-3-7-24(8-4-1)22-31(23-25-9-5-2-6-10-25)28-15-13-27(14-16-28)30-19-17-29(18-20-30)21-26-11-12-26;2*22-20-13-11-19(12-14-20)21(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18;2*15-13-16-7-9-6-10-12(20)17-8-14(4-2-1-3-5-14)19(10)11(9)18-13;2*15-13-3-5-14(6-4-13)17-9-7-16(8-10-17)11-12-1-2-12;1-13(2,3)17-12(16)15-8-6-14(7-9-15)10-11-4-5-11;1-9(2,3)13-8(12)11-6-4-10-5-7-11;1-2-8(1)7-10-5-3-9-4-6-10;1-4(8)11-7(12-5(2)9)13-6(3)10;7-5-1-3-6(8)4-2-5;3-2(4,5)1-6;1-3-2;2*2-1-4-3;;;;;;;;/h2*16-17,20,22-23H,1-15,18-19H2,(H,30,36)(H,29,31,32);2*1-10,26-28H,11-23H2;1-10,19-20,22H,11-16H2;1-10,19H,11-16H2;2*6-7H,1-5,8H2,(H,17,20);2*12-14H,1-11,15H2;11H,4-10H2,1-3H3;10H,4-7H2,1-3H3;8-9H,1-7H2;1-3H3;5-6,8H,1-4,7H2;1H;3H,1-2H3;2*1,3H;;;;;;;;/q;;;;;;;;;;;;;;;;;;;5*+1;3*-1/p-2
InChIKeyQFWGLHPALXUQPS-UHFFFAOYSA-L
MW4798.24 g/mol
LogP19.85
Rot. Bonds51

About tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde

tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde (PubChem CID 159773421) has the molecular formula C256H385BCl2F3K4N43NaO24P and a molecular weight of 4798.24 g/mol. Its IUPAC name is tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde.

Molecular Properties

Compound Nametetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde
PubChem CID159773421
Molecular FormulaC256H385BCl2F3K4N43NaO24P
Molecular Weight4798.24 g/mol
Exact Mass4793.78
IUPAC Nametetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde
SMILESC1CN(CC2CC2)CCN1.CC(=O)OB(OC(C)=O)OC(C)=O.CC(C)(C)OC(=O)N1CCN(CC2CC2)CC1.CC(C)(C)OC(=O)N1CCNCC1.CPC.NC1CCC(N2CCN(CC3CC3)CC2)CC1.NC1CCC(N2CCN(CC3CC3)CC2)CC1.NC1CCC(O)CC1.O=C1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1.O=C1NCC2(CCCCC2)n2c1cc1cnc(Cl)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(Cl)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(NC3CCC(N4CCN(CC5CC5)CC4)CC3)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(NC3CCC(N4CCN(CC5CC5)CC4)CC3)nc12.O=CC(F)(F)F.O=CO[O-].O=CO[O-].OC1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1.[H-].[H-].[H-].[K+].[K+].[K+].[K+].[Na+].c1ccc(CN(Cc2ccccc2)C2CCC(N3CCN(CC4CC4)CC3)CC2)cc1.c1ccc(CN(Cc2ccccc2)C2CCC(N3CCN(CC4CC4)CC3)CC2)cc1
InChIInChI=1S/2C28H41N7O.2C28H39N3.C20H25NO.C20H23NO.2C14H15ClN4O.2C14H27N3.C13H24N2O2.C9H18N2O2.C8H16N2.C6H9BO6.C6H13NO.C2HF3O.C2H7P.2CH2O3.4K.Na.3H/c2*36-26-24-16-21-17-29-27(32-25(21)35(24)28(19-30-26)10-2-1-3-11-28)31-22-6-8-23(9-7-22)34-14-12-33(13-15-34)18-20-4-5-20;2*1-3-7-24(8-4-1)22-31(23-25-9-5-2-6-10-25)28-15-13-27(14-16-28)30-19-17-29(18-20-30)21-26-11-12-26;2*22-20-13-11-19(12-14-20)21(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18;2*15-13-16-7-9-6-10-12(20)17-8-14(4-2-1-3-5-14)19(10)11(9)18-13;2*15-13-3-5-14(6-4-13)17-9-7-16(8-10-17)11-12-1-2-12;1-13(2,3)17-12(16)15-8-6-14(7-9-15)10-11-4-5-11;1-9(2,3)13-8(12)11-6-4-10-5-7-11;1-2-8(1)7-10-5-3-9-4-6-10;1-4(8)11-7(12-5(2)9)13-6(3)10;7-5-1-3-6(8)4-2-5;3-2(4,5)1-6;1-3-2;2*2-1-4-3;;;;;;;;/h2*16-17,20,22-23H,1-15,18-19H2,(H,30,36)(H,29,31,32);2*1-10,26-28H,11-23H2;1-10,19-20,22H,11-16H2;1-10,19H,11-16H2;2*6-7H,1-5,8H2,(H,17,20);2*12-14H,1-11,15H2;11H,4-10H2,1-3H3;10H,4-7H2,1-3H3;8-9H,1-7H2;1-3H3;5-6,8H,1-4,7H2;1H;3H,1-2H3;2*1,3H;;;;;;;;/q;;;;;;;;;;;;;;;;;;;5*+1;3*-1/p-2
InChIKeyQFWGLHPALXUQPS-UHFFFAOYSA-L
XLogP19.85
TPSA735.04 Ų
H-Bond Donors13
H-Bond Acceptors61
Rotatable Bonds51
Heavy Atoms335
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004798.24
LogP ≤ 519.85
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1061

Analyze tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde with MolForge

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Launch Full Analysis

Related Compounds

tert-butyl (3S,4R)-4-methyl-3-[(10-oxospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-4-yl)amino]piperidine-1-carboxylate
CID 155223105
tert-butyl (3S)-3-[(10-oxospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-4-yl)carbamoyl]pyrrolidine-1-carboxylate
CID 155222966
2-[[4-[4-(cyclopentylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[7,8-dihydropyrimido[5,4-b]indolizine-9,1'-cyclohexane]-6-one;2-[[4-[4-(cyclopropanecarbonyl)piperazin-1-yl]cyclohexyl]amino]spiro[7,8-dihydropyrimido[5,4-b]indolizine-9,1'-cyclohexane]-6-one;2-[[4-[4-[cyclopropyl(difluoro)methyl]piperazin-1-yl]cyclohexyl]amino]spiro[7,8-dihydropyrimido[5,4-b]indolizine-9,1'-cyclohexane]-6-one;2-[[4-[(2,4-difluorophenyl)methylamino]cyclohexyl]amino]spiro[7,8-dihydropyrimido[5,4-b]indolizine-9,1'-cyclohexane]-6-one;2-[[4-[1-(2-fluorophenyl)ethylamino]cyclohexyl]amino]spiro[7,8-dihydropyrimido[5,4-b]indolizine-9,1'-cyclohexane]-6-one;4-[[4-[(4-fluorophenyl)methylamino]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one
CID 161255797
dipotassium;1-(bromomethyl)-3-(trifluoromethyl)benzene;tert-butyl piperazine-1-carboxylate;tert-butyl 4-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxylate;dichloromethane;hydride;methane;oxido formate;1-[[3-(trifluoromethyl)phenyl]methyl]piperazine
CID 161179154
4-[[(3R)-piperidin-3-yl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one
CID 155209060
4-[4-(piperazine-1-carbonyl)anilino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one
CID 162360217
lithium;benzyl 4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]piperazine-1-carboxylate;benzyl piperazine-1-carboxylate;tert-butyl 4-[4-[5-[[4-(3-chloro-4-isocyanophenoxy)cyclohexyl]carbamoyl]pyrimidin-2-yl]piperazin-1-yl]piperidine-1-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;tert-butyl 4-piperazin-1-ylpiperidine-1-carboxylate;4-(3-chloro-4-isocyanophenoxy)cyclohexan-1-amine;N-[4-(3-chloro-4-isocyanophenoxy)cyclohexyl]-2-[4-[1-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]piperidin-4-yl]piperazin-1-yl]pyrimidine-5-carboxamide;N-[4-(3-chloro-4-isocyanophenoxy)cyclohexyl]-2-(4-piperidin-4-ylpiperazin-1-yl)pyrimidine-5-carboxamide;2-(2,6-dioxopiperidin-3-yl)-5-fluoroisoindole-1,3-dione;ethyl 2-chloropyrimidine-5-carboxylate;ethyl 2-[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]piperazin-1-yl]pyrimidine-5-carboxylate;methane;2-[4-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]piperazin-1-yl]pyrimidine-5-carboxylic acid;2,2,2-trifluoroacetaldehyde;hydroxide
CID 157293051
4-[[5-[4-(3,3-dimethylbutyl)piperazin-1-yl]-2-pyridinyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one
CID 145041166
tert-butyl 3-[[2-(benzylamino)-6-(2,6-dichlorophenyl)pyrrolo[2,3-d]pyrimidin-7-yl]methyl]piperidine-1-carboxylate
CID 67416831
4-[[5-[4-[3-(diethylamino)pyrrolidin-1-yl]piperidin-1-yl]-2-pyridinyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one
CID 86304865
bis(butanedioic acid);tert-butyl 4-(6-amino-3-pyridinyl)piperazine-1-carboxylate;tert-butyl 4-[6-[[7-cyclopentyl-6-(dimethylcarbamoyl)pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-pyridinyl]piperazine-1-carboxylate;2-chloro-7-cyclopentyl-N,N-dimethylpyrrolo[2,3-d]pyrimidine-6-carboxamide;bis(7-cyclopentyl-N,N-dimethyl-2-[(5-piperazin-1-yl-2-pyridinyl)amino]pyrrolo[2,3-d]pyrimidine-6-carboxamide);methane
CID 160753790
2-bromo-N,N-dimethylethanamine;tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(6-cyano-8-cyclopentyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]piperidine-1-carboxylate;8-cyclopentyl-2-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]amino]-7-oxopyrido[2,3-d]pyrimidine-6-carbonitrile;8-cyclopentyl-2-methylsulfinyl-7-oxopyrido[2,3-d]pyrimidine-6-carbonitrile;8-cyclopentyl-7-oxo-2-(piperidin-4-ylamino)pyrido[2,3-d]pyrimidine-6-carbonitrile;hydrobromide
CID 167653176

Frequently Asked Questions

What is the IUPAC name of tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde?
The IUPAC name of tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde (CID 159773421) is tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde.
What is the SMILES notation for tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde?
The canonical SMILES for tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde is C1CN(CC2CC2)CCN1.CC(=O)OB(OC(C)=O)OC(C)=O.CC(C)(C)OC(=O)N1CCN(CC2CC2)CC1.CC(C)(C)OC(=O)N1CCNCC1.CPC.NC1CCC(N2CCN(CC3CC3)CC2)CC1.NC1CCC(N2CCN(CC3CC3)CC2)CC1.NC1CCC(O)CC1.O=C1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1.O=C1NCC2(CCCCC2)n2c1cc1cnc(Cl)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(Cl)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(NC3CCC(N4CCN(CC5CC5)CC4)CC3)nc12.O=C1NCC2(CCCCC2)n2c1cc1cnc(NC3CCC(N4CCN(CC5CC5)CC4)CC3)nc12.O=CC(F)(F)F.O=CO[O-].O=CO[O-].OC1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1.[H-].[H-].[H-].[K+].[K+].[K+].[K+].[Na+].c1ccc(CN(Cc2ccccc2)C2CCC(N3CCN(CC4CC4)CC3)CC2)cc1.c1ccc(CN(Cc2ccccc2)C2CCC(N3CCN(CC4CC4)CC3)CC2)cc1.
What is the InChIKey of tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde?
The InChIKey is QFWGLHPALXUQPS-UHFFFAOYSA-L. The full InChI is InChI=1S/2C28H41N7O.2C28H39N3.C20H25NO.C20H23NO.2C14H15ClN4O.2C14H27N3.C13H24N2O2.C9H18N2O2.C8H16N2.C6H9BO6.C6H13NO.C2HF3O.C2H7P.2CH2O3.4K.Na.3H/c2*36-26-24-16-21-17-29-27(32-25(21)35(24)28(19-30-26)10-2-1-3-11-28)31-22-6-8-23(9-7-22)34-14-12-33(13-15-34)18-20-4-5-20;2*1-3-7-24(8-4-1)22-31(23-25-9-5-2-6-10-25)28-15-13-27(14-16-28)30-19-17-29(18-20-30)21-26-11-12-26;2*22-20-13-11-19(12-14-20)21(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18;2*15-13-16-7-9-6-10-12(20)17-8-14(4-2-1-3-5-14)19(10)11(9)18-13;2*15-13-3-5-14(6-4-13)17-9-7-16(8-10-17)11-12-1-2-12;1-13(2,3)17-12(16)15-8-6-14(7-9-15)10-11-4-5-11;1-9(2,3)13-8(12)11-6-4-10-5-7-11;1-2-8(1)7-10-5-3-9-4-6-10;1-4(8)11-7(12-5(2)9)13-6(3)10;7-5-1-3-6(8)4-2-5;3-2(4,5)1-6;1-3-2;2*2-1-4-3;;;;;;;;/h2*16-17,20,22-23H,1-15,18-19H2,(H,30,36)(H,29,31,32);2*1-10,26-28H,11-23H2;1-10,19-20,22H,11-16H2;1-10,19H,11-16H2;2*6-7H,1-5,8H2,(H,17,20);2*12-14H,1-11,15H2;11H,4-10H2,1-3H3;10H,4-7H2,1-3H3;8-9H,1-7H2;1-3H3;5-6,8H,1-4,7H2;1H;3H,1-2H3;2*1,3H;;;;;;;;/q;;;;;;;;;;;;;;;;;;;5*+1;3*-1/p-2.
What are the key properties of tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde?
tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde has a molecular weight of 4798.24 g/mol, XLogP of 19.85, 51 rotatable bonds, 13 hydrogen bond donors, and 61 hydrogen bond acceptors.
Where does this data come from?
All data for tetrapotassium;sodium;4-aminocyclohexan-1-ol;tert-butyl 4-(cyclopropylmethyl)piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;bis(4-chlorospiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);1-(cyclopropylmethyl)piperazine;bis(4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);bis(4-[[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one);diacetyloxyboranyl acetate;4-(dibenzylamino)cyclohexan-1-ol;4-(dibenzylamino)cyclohexan-1-one;bis(N,N-dibenzyl-4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine);dimethylphosphane;hydride;oxido formate;2,2,2-trifluoroacetaldehyde is sourced from PubChem (CID 159773421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).