1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine

C143H182F6N8O5 — CID 158121375

IUPAC1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine
SMILESC#Cc1ccc(-c2ccc(C(C)C)cc2C)cn1.CC(C)c1ccc(O)c(C(C)C)c1.CCOc1ccc(C(C)C)cc1C(F)(F)F.CCn1cnc(-c2ccc(C(C)C)cc2C)c1.COc1cc(C(C)C)ccc1OCC(C)(C)F.COc1ccccc1-c1ccc(C(C)C)cc1C.Cc1cc(-c2ccc(C(C)C)cc2C)ccn1.Cc1cc(C(C)C)ccc1-c1ccn(C)n1.Cc1cc(C(C)C)ccc1-c1cnn(C)c1.Cc1cc(C(C)C)ccc1C(C)(F)F
InChIInChI=1S/C17H17N.C17H20O.C16H19N.C15H20N2.C14H21FO2.2C14H18N2.C12H15F3O.C12H16F2.C12H18O/c1-5-16-8-6-15(11-18-16)17-9-7-14(12(2)3)10-13(17)4;1-12(2)14-9-10-15(13(3)11-14)16-7-5-6-8-17(16)18-4;1-11(2)14-5-6-16(12(3)9-14)15-7-8-17-13(4)10-15;1-5-17-9-15(16-10-17)14-7-6-13(11(2)3)8-12(14)4;1-10(2)11-6-7-12(13(8-11)16-5)17-9-14(3,4)15;1-10(2)12-5-6-14(11(3)7-12)13-8-15-16(4)9-13;1-10(2)12-5-6-13(11(3)9-12)14-7-8-16(4)15-14;1-4-16-11-6-5-9(8(2)3)7-10(11)12(13,14)15;1-8(2)10-5-6-11(9(3)7-10)12(4,13)14;1-8(2)10-5-6-12(13)11(7-10)9(3)4/h1,6-12H,2-4H3;5-12H,1-4H3;5-11H,1-4H3;6-11H,5H2,1-4H3;6-8,10H,9H2,1-5H3;2*5-10H,1-4H3;5-8H,4H2,1-3H3;5-8H,1-4H3;5-9,13H,1-4H3
InChIKeyFRQJXYAZNIGIMZ-UHFFFAOYSA-N
MW2207.07 g/mol
LogP40.53
Rot. Bonds26

About 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine

1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine (PubChem CID 158121375) has the molecular formula C143H182F6N8O5 and a molecular weight of 2207.07 g/mol. Its IUPAC name is 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine.

Molecular Properties

Compound Name1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine
PubChem CID158121375
Molecular FormulaC143H182F6N8O5
Molecular Weight2207.07 g/mol
Exact Mass2205.41
IUPAC Name1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine
SMILESC#Cc1ccc(-c2ccc(C(C)C)cc2C)cn1.CC(C)c1ccc(O)c(C(C)C)c1.CCOc1ccc(C(C)C)cc1C(F)(F)F.CCn1cnc(-c2ccc(C(C)C)cc2C)c1.COc1cc(C(C)C)ccc1OCC(C)(C)F.COc1ccccc1-c1ccc(C(C)C)cc1C.Cc1cc(-c2ccc(C(C)C)cc2C)ccn1.Cc1cc(C(C)C)ccc1-c1ccn(C)n1.Cc1cc(C(C)C)ccc1-c1cnn(C)c1.Cc1cc(C(C)C)ccc1C(C)(F)F
InChIInChI=1S/C17H17N.C17H20O.C16H19N.C15H20N2.C14H21FO2.2C14H18N2.C12H15F3O.C12H16F2.C12H18O/c1-5-16-8-6-15(11-18-16)17-9-7-14(12(2)3)10-13(17)4;1-12(2)14-9-10-15(13(3)11-14)16-7-5-6-8-17(16)18-4;1-11(2)14-5-6-16(12(3)9-14)15-7-8-17-13(4)10-15;1-5-17-9-15(16-10-17)14-7-6-13(11(2)3)8-12(14)4;1-10(2)11-6-7-12(13(8-11)16-5)17-9-14(3,4)15;1-10(2)12-5-6-14(11(3)7-12)13-8-15-16(4)9-13;1-10(2)12-5-6-13(11(3)9-12)14-7-8-16(4)15-14;1-4-16-11-6-5-9(8(2)3)7-10(11)12(13,14)15;1-8(2)10-5-6-11(9(3)7-10)12(4,13)14;1-8(2)10-5-6-12(13)11(7-10)9(3)4/h1,6-12H,2-4H3;5-12H,1-4H3;5-11H,1-4H3;6-11H,5H2,1-4H3;6-8,10H,9H2,1-5H3;2*5-10H,1-4H3;5-8H,4H2,1-3H3;5-8H,1-4H3;5-9,13H,1-4H3
InChIKeyFRQJXYAZNIGIMZ-UHFFFAOYSA-N
XLogP40.53
TPSA136.39 Ų
H-Bond Donors1
H-Bond Acceptors13
Rotatable Bonds26
Heavy Atoms162
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002207.07
LogP ≤ 540.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine with MolForge

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Related Compounds

3-[(1S)-1-[3-methoxy-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]ethyl]-6-(2-methyl-1,5-dihydropyrazol-4-yl)imidazo[4,5-b]pyridin-2-amine;3-[(1R)-1-[3-methoxy-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]ethyl]-6-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyridin-2-amine
CID 157272389
1-(1,1-Difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;2-fluoro-1-phenyl-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;2-methoxy-1-phenyl-4-propan-2-ylbenzene;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine;2-phenyl-5-propan-2-ylphenol
CID 159909225
2-(1,1-Difluoroethyl)-1-ethoxy-4-propan-2-ylbenzene;1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(1-fluoroethoxy)-2-propan-2-ylbenzene;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;2-fluoro-1-phenyl-4-propan-2-ylbenzene;bis(2-methoxy-1-methyl-3-propan-2-ylbenzene);1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;2-methoxy-1-phenyl-4-propan-2-ylbenzene;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine;2-phenyl-5-propan-2-ylphenol
CID 161247363
3-[(1R)-1-[3-methoxy-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]ethyl]-6-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyridin-2-amine;3-[(1S)-1-[3-methoxy-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]ethyl]-6-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyridin-2-amine
CID 161942080
1,5-dimethyl-2,3-di(propan-2-yl)pyrrole;1,2-di(propan-2-yl)benzene;4,5-di(propan-2-yl)-2H-imidazole;2,3-di(propan-2-yl)pyrazine;2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;bis(1,2-di(propan-2-yl)-4-(trifluoromethyl)benzene);bis(4-fluoro-1,2-di(propan-2-yl)benzene);4-methoxy-1,2-di(propan-2-yl)benzene;bis(4-methyl-1,2-di(propan-2-yl)benzene);5-methyl-2,3-di(propan-2-yl)pyrazine;1-methyl-4,5-di(propan-2-yl)pyrazole
CID 162097252
1,5-dimethyl-2,3-di(propan-2-yl)pyrrole;1,2-di(propan-2-yl)benzene;4,5-di(propan-2-yl)-2H-imidazole;2,3-di(propan-2-yl)pyrazine;2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;bis(1,2-di(propan-2-yl)-4-(trifluoromethyl)benzene);bis(4-fluoro-1,2-di(propan-2-yl)benzene);methane;4-methoxy-1,2-di(propan-2-yl)benzene;bis(4-methyl-1,2-di(propan-2-yl)benzene);5-methyl-2,3-di(propan-2-yl)pyrazine;1-methyl-4,5-di(propan-2-yl)pyrazole
CID 162173197
1-(Difluoromethoxy)-2-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-fluoro-2-methoxy-3-propan-2-ylbenzene;2-methoxy-1-methyl-3-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine
CID 160310649
5-[1-(1,1-Dideuterioethyl)pyrazol-4-yl]-2-propan-2-ylphenol;5-(1-ethylpyrazol-4-yl)-4-fluoro-2-propan-2-ylphenol;5-[2-(1-fluoroethoxy)-4-pyridinyl]-2-propan-2-ylphenol;5-[1-(1-fluoroethyl)pyrazol-4-yl]-2-propan-2-ylphenol;5-(4-methylimidazol-1-yl)-2-propan-2-ylphenol;5-(1-methyl-2-methylidenepyrimidin-4-yl)-2-propan-2-ylphenol;5-(4-methylpyrazol-1-yl)-2-propan-2-ylphenol
CID 163479905
5-[2-(1,1-Dideuterioethoxy)-6-fluoro-4-pyridinyl]-2-propan-2-ylphenol;5-(5-ethynyl-1-methylpyrrol-3-yl)-2-propan-2-ylphenol;5-(2-ethynyl-4-pyridinyl)-2-propan-2-ylphenol;5-(2-fluoro-6-methyl-4-pyridinyl)-2-propan-2-ylphenol;5-(4-methylimidazol-1-yl)-2-propan-2-ylphenol;5-(4-methylpyrazol-1-yl)-2-propan-2-ylphenol;5-(3-methylpyrrol-1-yl)-2-propan-2-ylphenol
CID 164053646

Frequently Asked Questions

What is the IUPAC name of 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine?
The IUPAC name of 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine (CID 158121375) is 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine.
What is the SMILES notation for 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine?
The canonical SMILES for 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine is C#Cc1ccc(-c2ccc(C(C)C)cc2C)cn1.CC(C)c1ccc(O)c(C(C)C)c1.CCOc1ccc(C(C)C)cc1C(F)(F)F.CCn1cnc(-c2ccc(C(C)C)cc2C)c1.COc1cc(C(C)C)ccc1OCC(C)(C)F.COc1ccccc1-c1ccc(C(C)C)cc1C.Cc1cc(-c2ccc(C(C)C)cc2C)ccn1.Cc1cc(C(C)C)ccc1-c1ccn(C)n1.Cc1cc(C(C)C)ccc1-c1cnn(C)c1.Cc1cc(C(C)C)ccc1C(C)(F)F.
What is the InChIKey of 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine?
The InChIKey is FRQJXYAZNIGIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N.C17H20O.C16H19N.C15H20N2.C14H21FO2.2C14H18N2.C12H15F3O.C12H16F2.C12H18O/c1-5-16-8-6-15(11-18-16)17-9-7-14(12(2)3)10-13(17)4;1-12(2)14-9-10-15(13(3)11-14)16-7-5-6-8-17(16)18-4;1-11(2)14-5-6-16(12(3)9-14)15-7-8-17-13(4)10-15;1-5-17-9-15(16-10-17)14-7-6-13(11(2)3)8-12(14)4;1-10(2)11-6-7-12(13(8-11)16-5)17-9-14(3,4)15;1-10(2)12-5-6-14(11(3)7-12)13-8-15-16(4)9-13;1-10(2)12-5-6-13(11(3)9-12)14-7-8-16(4)15-14;1-4-16-11-6-5-9(8(2)3)7-10(11)12(13,14)15;1-8(2)10-5-6-11(9(3)7-10)12(4,13)14;1-8(2)10-5-6-12(13)11(7-10)9(3)4/h1,6-12H,2-4H3;5-12H,1-4H3;5-11H,1-4H3;6-11H,5H2,1-4H3;6-8,10H,9H2,1-5H3;2*5-10H,1-4H3;5-8H,4H2,1-3H3;5-8H,1-4H3;5-9,13H,1-4H3.
What are the key properties of 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine?
1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine has a molecular weight of 2207.07 g/mol, XLogP of 40.53, 26 rotatable bonds, 1 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1-difluoroethyl)-2-methyl-4-propan-2-ylbenzene;2,4-di(propan-2-yl)phenol;1-ethoxy-4-propan-2-yl-2-(trifluoromethyl)benzene;1-ethyl-4-(2-methyl-4-propan-2-ylphenyl)imidazole;2-ethynyl-5-(2-methyl-4-propan-2-ylphenyl)pyridine;1-(2-fluoro-2-methylpropoxy)-2-methoxy-4-propan-2-ylbenzene;1-(2-methoxyphenyl)-2-methyl-4-propan-2-ylbenzene;1-methyl-3-(2-methyl-4-propan-2-ylphenyl)pyrazole;1-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyrazole;2-methyl-4-(2-methyl-4-propan-2-ylphenyl)pyridine is sourced from PubChem (CID 158121375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).