1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide

C243H432N18O18S4-2 — CID 158584649

IUPAC1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide
SMILESCC(C)C1CCC(CC2CCCCC2)CC1.CC(C)C1CCC(C[N+]2(C)CCCCC2)C1.CC(C)C1CCC(C[N+]2(C)CCCCC2)CC1.CC(C)C1CCC(C[NH+]2CCCCC2)C1.CC(C)C1CCC(C[n+]2ccccc2)C1.CC(C)C1CCC(C[n+]2ccccc2)CC1.CC(C)C1CCC(C[n+]2ccsc2)C1.CC(C)C1CCC(C[n+]2ccsc2)CC1.CC(C)CC[N+]1(C)CCCCC1.CC(C)CC[NH+]1CCCCC1.CC(C)CC[n+]1ccccc1.CC(C)CC[n+]1ccsc1.CC(C)c1ccc(CC2CCCCC2)cc1.CC(C)c1ccc(C[N+]2(C)CCCCC2)cc1.CC(C)c1ccc(C[n+]2ccccc2)cc1.CC(C)c1ccc(C[n+]2ccsc2)cc1.CCn1cc[n+](CC2CCC(C(C)C)C2)c1.CCn1cc[n+](Cc2ccc(C(C)C)cc2)c1.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-]
InChIInChI=1S/C16H32N.C16H26N.C16H30.C16H24.C15H21N2.C15H30N.C15H24N.C15H18N.C14H25N2.C14H27N.C14H22N.C13H22NS.C13H16NS.C12H20NS.C11H24N.C10H21N.C10H16N.C8H14NS.18H2O/c2*1-14(2)16-9-7-15(8-10-16)13-17(3)11-5-4-6-12-17;2*1-13(2)16-10-8-15(9-11-16)12-14-6-4-3-5-7-14;1-4-16-9-10-17(12-16)11-14-5-7-15(8-6-14)13(2)3;1-13(2)15-8-7-14(11-15)12-16(3)9-5-4-6-10-16;2*1-13(2)15-8-6-14(7-9-15)12-16-10-4-3-5-11-16;1-4-15-7-8-16(11-15)10-13-5-6-14(9-13)12(2)3;2*1-12(2)14-7-6-13(10-14)11-15-8-4-3-5-9-15;2*1-11(2)13-5-3-12(4-6-13)9-14-7-8-15-10-14;1-10(2)12-4-3-11(7-12)8-13-5-6-14-9-13;1-11(2)7-10-12(3)8-5-4-6-9-12;2*1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)3-4-9-5-6-10-7-9;;;;;;;;;;;;;;;;;;/h14-16H,4-13H2,1-3H3;7-10,14H,4-6,11-13H2,1-3H3;13-16H,3-12H2,1-2H3;8-11,13-14H,3-7,12H2,1-2H3;5-10,12-13H,4,11H2,1-3H3;13-15H,4-12H2,1-3H3;3-5,10-11,13-15H,6-9,12H2,1-2H3;3-11,13H,12H2,1-2H3;7-8,11-14H,4-6,9-10H2,1-3H3;12-14H,3-11H2,1-2H3;3-5,8-9,12-14H,6-7,10-11H2,1-2H3;7-8,10-13H,3-6,9H2,1-2H3;3-8,10-11H,9H2,1-2H3;5-6,9-12H,3-4,7-8H2,1-2H3;11H,4-10H2,1-3H3;10H,3-9H2,1-2H3;3-5,7-8,10H,6,9H2,1-2H3;5-8H,3-4H2,1-2H3;18*1H2/q2*+1;;;5*+1;;5*+1;;2*+1;;;;;;;;;;;;;;;;;;/p-16
InChIKeyVCLQSHNWHHFWBX-UHFFFAOYSA-A
MW4022.50 g/mol
LogP54.15
Rot. Bonds56

About 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide

1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide (PubChem CID 158584649) has the molecular formula C243H432N18O18S4-2 and a molecular weight of 4022.50 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide.

Molecular Properties

Compound Name1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide
PubChem CID158584649
Molecular FormulaC243H432N18O18S4-2
Molecular Weight4022.50 g/mol
Exact Mass4019.23
IUPAC Name1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide
SMILESCC(C)C1CCC(CC2CCCCC2)CC1.CC(C)C1CCC(C[N+]2(C)CCCCC2)C1.CC(C)C1CCC(C[N+]2(C)CCCCC2)CC1.CC(C)C1CCC(C[NH+]2CCCCC2)C1.CC(C)C1CCC(C[n+]2ccccc2)C1.CC(C)C1CCC(C[n+]2ccccc2)CC1.CC(C)C1CCC(C[n+]2ccsc2)C1.CC(C)C1CCC(C[n+]2ccsc2)CC1.CC(C)CC[N+]1(C)CCCCC1.CC(C)CC[NH+]1CCCCC1.CC(C)CC[n+]1ccccc1.CC(C)CC[n+]1ccsc1.CC(C)c1ccc(CC2CCCCC2)cc1.CC(C)c1ccc(C[N+]2(C)CCCCC2)cc1.CC(C)c1ccc(C[n+]2ccccc2)cc1.CC(C)c1ccc(C[n+]2ccsc2)cc1.CCn1cc[n+](CC2CCC(C(C)C)C2)c1.CCn1cc[n+](Cc2ccc(C(C)C)cc2)c1.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-]
InChIInChI=1S/C16H32N.C16H26N.C16H30.C16H24.C15H21N2.C15H30N.C15H24N.C15H18N.C14H25N2.C14H27N.C14H22N.C13H22NS.C13H16NS.C12H20NS.C11H24N.C10H21N.C10H16N.C8H14NS.18H2O/c2*1-14(2)16-9-7-15(8-10-16)13-17(3)11-5-4-6-12-17;2*1-13(2)16-10-8-15(9-11-16)12-14-6-4-3-5-7-14;1-4-16-9-10-17(12-16)11-14-5-7-15(8-6-14)13(2)3;1-13(2)15-8-7-14(11-15)12-16(3)9-5-4-6-10-16;2*1-13(2)15-8-6-14(7-9-15)12-16-10-4-3-5-11-16;1-4-15-7-8-16(11-15)10-13-5-6-14(9-13)12(2)3;2*1-12(2)14-7-6-13(10-14)11-15-8-4-3-5-9-15;2*1-11(2)13-5-3-12(4-6-13)9-14-7-8-15-10-14;1-10(2)12-4-3-11(7-12)8-13-5-6-14-9-13;1-11(2)7-10-12(3)8-5-4-6-9-12;2*1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)3-4-9-5-6-10-7-9;;;;;;;;;;;;;;;;;;/h14-16H,4-13H2,1-3H3;7-10,14H,4-6,11-13H2,1-3H3;13-16H,3-12H2,1-2H3;8-11,13-14H,3-7,12H2,1-2H3;5-10,12-13H,4,11H2,1-3H3;13-15H,4-12H2,1-3H3;3-5,10-11,13-15H,6-9,12H2,1-2H3;3-11,13H,12H2,1-2H3;7-8,11-14H,4-6,9-10H2,1-3H3;12-14H,3-11H2,1-2H3;3-5,8-9,12-14H,6-7,10-11H2,1-2H3;7-8,10-13H,3-6,9H2,1-2H3;3-8,10-11H,9H2,1-2H3;5-6,9-12H,3-4,7-8H2,1-2H3;11H,4-10H2,1-3H3;10H,3-9H2,1-2H3;3-5,7-8,10H,6,9H2,1-2H3;5-8H,3-4H2,1-2H3;18*1H2/q2*+1;;;5*+1;;5*+1;;2*+1;;;;;;;;;;;;;;;;;;/p-16
InChIKeyVCLQSHNWHHFWBX-UHFFFAOYSA-A
XLogP54.15
TPSA597.54 Ų
H-Bond Donors2
H-Bond Acceptors24
Rotatable Bonds56
Heavy Atoms283
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004022.50
LogP ≤ 554.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1024

Analyze 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide with MolForge

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Launch Full Analysis

Related Compounds

CID 157255402
CID 157255402
1-(Cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;3-(3-methylbutyl)-1,3-oxazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-oxazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium
CID 157345363
1-(cyclopenta-2,4-dien-1-ylmethyl)-4-propan-2-ylbenzene;1-ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;1-(3-methylbutyl)-1H-pyrazol-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-(3-methylbutyl)imidazol-1-ium;1-methyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-1-ium;1-methyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-1-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;2-[(4-propan-2-ylcyclohexyl)methyl]-2H-pyrrole;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]-1H-pyrazol-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-(4-propan-2-ylphenyl)-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium
CID 158581124
1-Ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;methane;3-(3-methylbutyl)-1,3-oxazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-oxazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium
CID 160466454
1-Ethyl-3-(3-methylbutyl)imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylcyclohexyl)methyl]imidazol-3-ium;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;3-(3-methylbutyl)-1,3-oxazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-oxazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-oxazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium
CID 162043685

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide?
The IUPAC name of 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide (CID 158584649) is 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide.
What is the SMILES notation for 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide?
The canonical SMILES for 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide is CC(C)C1CCC(CC2CCCCC2)CC1.CC(C)C1CCC(C[N+]2(C)CCCCC2)C1.CC(C)C1CCC(C[N+]2(C)CCCCC2)CC1.CC(C)C1CCC(C[NH+]2CCCCC2)C1.CC(C)C1CCC(C[n+]2ccccc2)C1.CC(C)C1CCC(C[n+]2ccccc2)CC1.CC(C)C1CCC(C[n+]2ccsc2)C1.CC(C)C1CCC(C[n+]2ccsc2)CC1.CC(C)CC[N+]1(C)CCCCC1.CC(C)CC[NH+]1CCCCC1.CC(C)CC[n+]1ccccc1.CC(C)CC[n+]1ccsc1.CC(C)c1ccc(CC2CCCCC2)cc1.CC(C)c1ccc(C[N+]2(C)CCCCC2)cc1.CC(C)c1ccc(C[n+]2ccccc2)cc1.CC(C)c1ccc(C[n+]2ccsc2)cc1.CCn1cc[n+](CC2CCC(C(C)C)C2)c1.CCn1cc[n+](Cc2ccc(C(C)C)cc2)c1.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].
What is the InChIKey of 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide?
The InChIKey is VCLQSHNWHHFWBX-UHFFFAOYSA-A. The full InChI is InChI=1S/C16H32N.C16H26N.C16H30.C16H24.C15H21N2.C15H30N.C15H24N.C15H18N.C14H25N2.C14H27N.C14H22N.C13H22NS.C13H16NS.C12H20NS.C11H24N.C10H21N.C10H16N.C8H14NS.18H2O/c2*1-14(2)16-9-7-15(8-10-16)13-17(3)11-5-4-6-12-17;2*1-13(2)16-10-8-15(9-11-16)12-14-6-4-3-5-7-14;1-4-16-9-10-17(12-16)11-14-5-7-15(8-6-14)13(2)3;1-13(2)15-8-7-14(11-15)12-16(3)9-5-4-6-10-16;2*1-13(2)15-8-6-14(7-9-15)12-16-10-4-3-5-11-16;1-4-15-7-8-16(11-15)10-13-5-6-14(9-13)12(2)3;2*1-12(2)14-7-6-13(10-14)11-15-8-4-3-5-9-15;2*1-11(2)13-5-3-12(4-6-13)9-14-7-8-15-10-14;1-10(2)12-4-3-11(7-12)8-13-5-6-14-9-13;1-11(2)7-10-12(3)8-5-4-6-9-12;2*1-10(2)6-9-11-7-4-3-5-8-11;1-8(2)3-4-9-5-6-10-7-9;;;;;;;;;;;;;;;;;;/h14-16H,4-13H2,1-3H3;7-10,14H,4-6,11-13H2,1-3H3;13-16H,3-12H2,1-2H3;8-11,13-14H,3-7,12H2,1-2H3;5-10,12-13H,4,11H2,1-3H3;13-15H,4-12H2,1-3H3;3-5,10-11,13-15H,6-9,12H2,1-2H3;3-11,13H,12H2,1-2H3;7-8,11-14H,4-6,9-10H2,1-3H3;12-14H,3-11H2,1-2H3;3-5,8-9,12-14H,6-7,10-11H2,1-2H3;7-8,10-13H,3-6,9H2,1-2H3;3-8,10-11H,9H2,1-2H3;5-6,9-12H,3-4,7-8H2,1-2H3;11H,4-10H2,1-3H3;10H,3-9H2,1-2H3;3-5,7-8,10H,6,9H2,1-2H3;5-8H,3-4H2,1-2H3;18*1H2/q2*+1;;;5*+1;;5*+1;;2*+1;;;;;;;;;;;;;;;;;;/p-16.
What are the key properties of 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide?
1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide has a molecular weight of 4022.50 g/mol, XLogP of 54.15, 56 rotatable bonds, 2 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)-4-propan-2-ylbenzene;1-(cyclohexylmethyl)-4-propan-2-ylcyclohexane;1-ethyl-3-[(3-propan-2-ylcyclopentyl)methyl]imidazol-3-ium;1-ethyl-3-[(4-propan-2-ylphenyl)methyl]imidazol-3-ium;1-(3-methylbutyl)piperidin-1-ium;1-(3-methylbutyl)pyridin-1-ium;3-(3-methylbutyl)-1,3-thiazol-3-ium;1-methyl-1-(3-methylbutyl)piperidin-1-ium;1-methyl-1-[(4-propan-2-ylcyclohexyl)methyl]piperidin-1-ium;1-methyl-1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium;1-[(4-propan-2-ylcyclohexyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylcyclohexyl)methyl]-1,3-thiazol-3-ium;1-[(3-propan-2-ylcyclopentyl)methyl]piperidin-1-ium;1-[(3-propan-2-ylcyclopentyl)methyl]pyridin-1-ium;3-[(3-propan-2-ylcyclopentyl)methyl]-1,3-thiazol-3-ium;1-[(4-propan-2-ylphenyl)methyl]pyridin-1-ium;3-[(4-propan-2-ylphenyl)methyl]-1,3-thiazol-3-ium;octadecahydroxide is sourced from PubChem (CID 158584649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).