1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol

C159H247N5O17S4 — CID 158086923

IUPAC1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol
SMILESCCCC(O)c1cc(/C=C/C2CCCCC2)ccn1.CCCC(O)c1ccc(/C=C/C2CCCCC2)s1.CCCC(O)c1ccc(OCC2CCCCC2)o1.CCCC(O)c1ccc(OCC2CCCCC2)s1.CCCC(O)c1cccc(/C=C/C2CCCCC2)n1.CCCC(O)c1cccc(CCC2CCCCC2)n1.CCCC(O)c1cccc(OCC2CCCCC2)n1.CCCC(O)c1csc(OCC2CCCCC2)c1.CCC[C@@H](O)c1ccc(OCC2CCCCC2)s1.CCC[C@@H](O)c1cccc(OCC2CCCCC2)n1
InChIInChI=1S/C17H27NO.2C17H25NO.2C16H25NO2.C16H24OS.C15H24O3.3C15H24O2S/c2*1-2-7-17(19)16-11-6-10-15(18-16)13-12-14-8-4-3-5-9-14;1-2-6-17(19)16-13-15(11-12-18-16)10-9-14-7-4-3-5-8-14;2*1-2-7-15(18)14-10-6-11-16(17-14)19-12-13-8-4-3-5-9-13;1-2-6-15(17)16-12-11-14(18-16)10-9-13-7-4-3-5-8-13;1-2-6-13(16)14-9-10-15(18-14)17-11-12-7-4-3-5-8-12;1-2-6-14(16)13-9-15(18-11-13)17-10-12-7-4-3-5-8-12;2*1-2-6-13(16)14-9-10-15(18-14)17-11-12-7-4-3-5-8-12/h6,10-11,14,17,19H,2-5,7-9,12-13H2,1H3;6,10-14,17,19H,2-5,7-9H2,1H3;9-14,17,19H,2-8H2,1H3;2*6,10-11,13,15,18H,2-5,7-9,12H2,1H3;9-13,15,17H,2-8H2,1H3;9-10,12-13,16H,2-8,11H2,1H3;9,11-12,14,16H,2-8,10H2,1H3;2*9-10,12-13,16H,2-8,11H2,1H3/b;13-12+;10-9+;;;10-9+;;;;/t;;;15-;;;;;13-;/m...1....1./s1
InChIKeyFNPXPIYZUOPUBZ-IIJPCLOFSA-N
MW2629.01 g/mol
LogP44.06
Rot. Bonds57

About 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol

1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol (PubChem CID 158086923) has the molecular formula C159H247N5O17S4 and a molecular weight of 2629.01 g/mol. Its IUPAC name is 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol.

Molecular Properties

Compound Name1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol
PubChem CID158086923
Molecular FormulaC159H247N5O17S4
Molecular Weight2629.01 g/mol
Exact Mass2626.75
IUPAC Name1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol
SMILESCCCC(O)c1cc(/C=C/C2CCCCC2)ccn1.CCCC(O)c1ccc(/C=C/C2CCCCC2)s1.CCCC(O)c1ccc(OCC2CCCCC2)o1.CCCC(O)c1ccc(OCC2CCCCC2)s1.CCCC(O)c1cccc(/C=C/C2CCCCC2)n1.CCCC(O)c1cccc(CCC2CCCCC2)n1.CCCC(O)c1cccc(OCC2CCCCC2)n1.CCCC(O)c1csc(OCC2CCCCC2)c1.CCC[C@@H](O)c1ccc(OCC2CCCCC2)s1.CCC[C@@H](O)c1cccc(OCC2CCCCC2)n1
InChIInChI=1S/C17H27NO.2C17H25NO.2C16H25NO2.C16H24OS.C15H24O3.3C15H24O2S/c2*1-2-7-17(19)16-11-6-10-15(18-16)13-12-14-8-4-3-5-9-14;1-2-6-17(19)16-13-15(11-12-18-16)10-9-14-7-4-3-5-8-14;2*1-2-7-15(18)14-10-6-11-16(17-14)19-12-13-8-4-3-5-9-13;1-2-6-15(17)16-12-11-14(18-16)10-9-13-7-4-3-5-8-13;1-2-6-13(16)14-9-10-15(18-14)17-11-12-7-4-3-5-8-12;1-2-6-14(16)13-9-15(18-11-13)17-10-12-7-4-3-5-8-12;2*1-2-6-13(16)14-9-10-15(18-14)17-11-12-7-4-3-5-8-12/h6,10-11,14,17,19H,2-5,7-9,12-13H2,1H3;6,10-14,17,19H,2-5,7-9H2,1H3;9-14,17,19H,2-8H2,1H3;2*6,10-11,13,15,18H,2-5,7-9,12H2,1H3;9-13,15,17H,2-8H2,1H3;9-10,12-13,16H,2-8,11H2,1H3;9,11-12,14,16H,2-8,10H2,1H3;2*9-10,12-13,16H,2-8,11H2,1H3/b;13-12+;10-9+;;;10-9+;;;;/t;;;15-;;;;;13-;/m...1....1./s1
InChIKeyFNPXPIYZUOPUBZ-IIJPCLOFSA-N
XLogP44.06
TPSA335.27 Ų
H-Bond Donors10
H-Bond Acceptors26
Rotatable Bonds57
Heavy Atoms185
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002629.01
LogP ≤ 544.06
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1026

Analyze 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol with MolForge

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Launch Full Analysis

Related Compounds

Dioxidanium;bis(3,5-bis(5-pyridin-4-ylthiophen-2-yl)pyridine);bis(4-(4-carboxyphenoxy)benzoate);nickel(2+)
CID 168338367
[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] 2,2-dimethylpropanoate;bis(5-[[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione);4-[(1S)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethoxy]-4-oxobutanoic acid;[(1S)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[(1R)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] benzoate
CID 157344452
[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] 2,2-dimethylpropanoate;bis(5-[[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione);4-[(1S)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethoxy]-4-oxobutanoic acid;[(1S)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[(1R)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-oxoethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione
CID 157485860
5-[[4-[(2R)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2S)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2R)-2-hydroxy-2-(3-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2S)-2-hydroxy-2-(3-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[2-(3-methoxyphenyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[2-(4-methoxyphenyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione
CID 158030605
[2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] benzoate;[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(6-ethyl-3-pyridinyl)ethyl] 2,2-dimethylpropanoate;4-[(1S)-1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethoxy]-4-oxobutanoic acid;[(1S)-1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[(1R)-1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] benzoate
CID 158340348
5-[[4-[(2R)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2S)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2R)-2-hydroxy-2-(3-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2S)-2-hydroxy-2-(3-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethoxy]phenyl]methyl]thiolane-2,4-dione;methane;5-[[4-[2-(3-methoxyphenyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[2-(4-methoxyphenyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione
CID 158678488
[(1S)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] acetate;[2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] benzoate;[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] hexanoate;4-[(1S)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethoxy]-4-oxobutanoic acid;[1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] benzoate;methane
CID 158766563
[(1S)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] acetate;[2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] benzoate;[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] 2,2-dimethylpropanoate;[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] hexanoate;5-[[4-[(2R)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione;5-[[4-[(2S)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione;methane
CID 158881019
[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(6-ethyl-3-pyridinyl)ethyl] 2,2-dimethylpropanoate;4-[(1S)-1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethoxy]-4-oxobutanoic acid;[(1S)-1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[(1R)-1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[1-(6-ethyl-3-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] benzoate
CID 159326750
5-[[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione;5-[[4-[(2S)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione;5-[[4-[(2R)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione;5-[[4-[(2R)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[(2S)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione
CID 159345856
[(1S)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(6-ethyl-3-pyridinyl)ethyl] acetate;[2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(5-ethyl-2-pyridinyl)ethyl] benzoate;[2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(6-ethyl-3-pyridinyl)ethyl] benzoate;[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(6-ethyl-3-pyridinyl)ethyl] 2,2-dimethylpropanoate;[(1R)-2-[4-[(3,5-dioxothiolan-2-yl)methyl]phenoxy]-1-(6-ethyl-3-pyridinyl)ethyl] hexanoate;methane
CID 159683209
bis(5-[[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione);5-[[4-[(2S)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione;5-[[4-[(2S)-2-(5-ethyl-2-pyridinyl)-2-hydroxyethoxy]phenyl]methyl]thiolane-2,4-dione;[(1S)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;[(1R)-1-(5-ethyl-2-pyridinyl)-2-[4-[(2-methyl-3,5-dioxothiolan-2-yl)methyl]phenoxy]ethyl] acetate;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-oxoethoxy]phenyl]methyl]-5-methylthiolane-2,4-dione;5-[[4-[2-(5-ethyl-2-pyridinyl)-2-oxoethoxy]phenyl]methyl]thiolane-2,4-dione
CID 159770094

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol?
The IUPAC name of 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol (CID 158086923) is 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol.
What is the SMILES notation for 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol?
The canonical SMILES for 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol is CCCC(O)c1cc(/C=C/C2CCCCC2)ccn1.CCCC(O)c1ccc(/C=C/C2CCCCC2)s1.CCCC(O)c1ccc(OCC2CCCCC2)o1.CCCC(O)c1ccc(OCC2CCCCC2)s1.CCCC(O)c1cccc(/C=C/C2CCCCC2)n1.CCCC(O)c1cccc(CCC2CCCCC2)n1.CCCC(O)c1cccc(OCC2CCCCC2)n1.CCCC(O)c1csc(OCC2CCCCC2)c1.CCC[C@@H](O)c1ccc(OCC2CCCCC2)s1.CCC[C@@H](O)c1cccc(OCC2CCCCC2)n1.
What is the InChIKey of 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol?
The InChIKey is FNPXPIYZUOPUBZ-IIJPCLOFSA-N. The full InChI is InChI=1S/C17H27NO.2C17H25NO.2C16H25NO2.C16H24OS.C15H24O3.3C15H24O2S/c2*1-2-7-17(19)16-11-6-10-15(18-16)13-12-14-8-4-3-5-9-14;1-2-6-17(19)16-13-15(11-12-18-16)10-9-14-7-4-3-5-8-14;2*1-2-7-15(18)14-10-6-11-16(17-14)19-12-13-8-4-3-5-9-13;1-2-6-15(17)16-12-11-14(18-16)10-9-13-7-4-3-5-8-13;1-2-6-13(16)14-9-10-15(18-14)17-11-12-7-4-3-5-8-12;1-2-6-14(16)13-9-15(18-11-13)17-10-12-7-4-3-5-8-12;2*1-2-6-13(16)14-9-10-15(18-14)17-11-12-7-4-3-5-8-12/h6,10-11,14,17,19H,2-5,7-9,12-13H2,1H3;6,10-14,17,19H,2-5,7-9H2,1H3;9-14,17,19H,2-8H2,1H3;2*6,10-11,13,15,18H,2-5,7-9,12H2,1H3;9-13,15,17H,2-8H2,1H3;9-10,12-13,16H,2-8,11H2,1H3;9,11-12,14,16H,2-8,10H2,1H3;2*9-10,12-13,16H,2-8,11H2,1H3/b;13-12+;10-9+;;;10-9+;;;;/t;;;15-;;;;;13-;/m...1....1./s1.
What are the key properties of 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol?
1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol has a molecular weight of 2629.01 g/mol, XLogP of 44.06, 57 rotatable bonds, 10 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[6-[(E)-2-cyclohexylethenyl]-2-pyridinyl]butan-1-ol;1-[5-[(E)-2-cyclohexylethenyl]thiophen-2-yl]butan-1-ol;1-[6-(2-cyclohexylethyl)-2-pyridinyl]butan-1-ol;1-[5-(cyclohexylmethoxy)furan-2-yl]butan-1-ol;(1R)-1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;1-[6-(cyclohexylmethoxy)-2-pyridinyl]butan-1-ol;(1R)-1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-2-yl]butan-1-ol;1-[5-(cyclohexylmethoxy)thiophen-3-yl]butan-1-ol is sourced from PubChem (CID 158086923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).