1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane

C170H225ClFN15O5SSi — CID 162090467

IUPAC1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane
SMILESCC(C)/C(F)=C/c1ccc(C#N)cc1.CC(C)/C=C/c1cccc(-c2cnco2)c1.CC(C)Cn1cc(C(C)C)cn1.CC(C)c1cc2c(Cl)cccc2n1C.CC(C)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2.CC(C)c1cc2ccc(C#N)cc2n1C.CC(C)c1ccc(C(C)(C)C)cc1.CC(C)c1ccc(OCc2ccccc2)cc1.CC(C)c1cccc(CC#N)c1.CC(C)c1cnc2c(c1)ncn2COCC[Si](C)(C)C.CC(C)c1cnn(C(C)c2ccccc2)c1.CCCn1c(C(C)C)cc2ccccc21.Cc1ccc(C(C)C)cc1C
InChIInChI=1S/C16H18O.C15H25N3OSi.C15H23NO2S.C14H18N2.C14H15NO.C14H19N.C13H14N2.C13H20.C12H14ClN.C12H12FN.C11H13N.C11H16.C10H18N2/c1-13(2)15-8-10-16(11-9-15)17-12-14-6-4-3-5-7-14;1-12(2)13-8-14-15(16-9-13)18(10-17-14)11-19-6-7-20(3,4)5;1-10(2)13-8-11-9-16(7-6-12(11)19-13)14(17)18-15(3,4)5;1-11(2)14-9-15-16(10-14)12(3)13-7-5-4-6-8-13;1-11(2)6-7-12-4-3-5-13(8-12)14-9-15-10-16-14;1-4-9-15-13-8-6-5-7-12(13)10-14(15)11(2)3;1-9(2)12-7-11-5-4-10(8-14)6-13(11)15(12)3;1-10(2)11-6-8-12(9-7-11)13(3,4)5;1-8(2)12-7-9-10(13)5-4-6-11(9)14(12)3;1-9(2)12(13)7-10-3-5-11(8-14)6-4-10;1-9(2)11-5-3-4-10(8-11)6-7-12;1-8(2)11-6-5-9(3)10(4)7-11;1-8(2)6-12-7-10(5-11-12)9(3)4/h3-11,13H,12H2,1-2H3;8-10,12H,6-7,11H2,1-5H3;8,10H,6-7,9H2,1-5H3;4-12H,1-3H3;3-11H,1-2H3;5-8,10-11H,4,9H2,1-3H3;4-7,9H,1-3H3;6-10H,1-5H3;4-8H,1-3H3;3-7,9H,1-2H3;3-5,8-9H,6H2,1-2H3;5-8H,1-4H3;5,7-9H,6H2,1-4H3/b;;;;7-6+;;;;;12-7-;;;
InChIKeyZDNOGJAHPZTYBQ-VMDWJZTRSA-N
MW2673.37 g/mol
LogP47.95
Rot. Bonds31

About 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane

1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane (PubChem CID 162090467) has the molecular formula C170H225ClFN15O5SSi and a molecular weight of 2673.37 g/mol. Its IUPAC name is 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane.

Molecular Properties

Compound Name1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane
PubChem CID162090467
Molecular FormulaC170H225ClFN15O5SSi
Molecular Weight2673.37 g/mol
Exact Mass2670.70
IUPAC Name1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane
SMILESCC(C)/C(F)=C/c1ccc(C#N)cc1.CC(C)/C=C/c1cccc(-c2cnco2)c1.CC(C)Cn1cc(C(C)C)cn1.CC(C)c1cc2c(Cl)cccc2n1C.CC(C)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2.CC(C)c1cc2ccc(C#N)cc2n1C.CC(C)c1ccc(C(C)(C)C)cc1.CC(C)c1ccc(OCc2ccccc2)cc1.CC(C)c1cccc(CC#N)c1.CC(C)c1cnc2c(c1)ncn2COCC[Si](C)(C)C.CC(C)c1cnn(C(C)c2ccccc2)c1.CCCn1c(C(C)C)cc2ccccc21.Cc1ccc(C(C)C)cc1C
InChIInChI=1S/C16H18O.C15H25N3OSi.C15H23NO2S.C14H18N2.C14H15NO.C14H19N.C13H14N2.C13H20.C12H14ClN.C12H12FN.C11H13N.C11H16.C10H18N2/c1-13(2)15-8-10-16(11-9-15)17-12-14-6-4-3-5-7-14;1-12(2)13-8-14-15(16-9-13)18(10-17-14)11-19-6-7-20(3,4)5;1-10(2)13-8-11-9-16(7-6-12(11)19-13)14(17)18-15(3,4)5;1-11(2)14-9-15-16(10-14)12(3)13-7-5-4-6-8-13;1-11(2)6-7-12-4-3-5-13(8-12)14-9-15-10-16-14;1-4-9-15-13-8-6-5-7-12(13)10-14(15)11(2)3;1-9(2)12-7-11-5-4-10(8-14)6-13(11)15(12)3;1-10(2)11-6-8-12(9-7-11)13(3,4)5;1-8(2)12-7-9-10(13)5-4-6-11(9)14(12)3;1-9(2)12(13)7-10-3-5-11(8-14)6-4-10;1-9(2)11-5-3-4-10(8-11)6-7-12;1-8(2)11-6-5-9(3)10(4)7-11;1-8(2)6-12-7-10(5-11-12)9(3)4/h3-11,13H,12H2,1-2H3;8-10,12H,6-7,11H2,1-5H3;8,10H,6-7,9H2,1-5H3;4-12H,1-3H3;3-11H,1-2H3;5-8,10-11H,4,9H2,1-3H3;4-7,9H,1-3H3;6-10H,1-5H3;4-8H,1-3H3;3-7,9H,1-2H3;3-5,8-9H,6H2,1-2H3;5-8H,1-4H3;5,7-9H,6H2,1-4H3/b;;;;7-6+;;;;;12-7-;;;
InChIKeyZDNOGJAHPZTYBQ-VMDWJZTRSA-N
XLogP47.95
TPSA226.54 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds31
Heavy Atoms194
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002673.37
LogP ≤ 547.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane with MolForge

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Launch Full Analysis

Related Compounds

1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-difluoro-4-propan-2-ylbenzene;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;N-(3-methoxyphenyl)-2-methylpropanamide;3-methyl-1-(2-methylindazol-6-yl)butan-2-one;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane
CID 157237064
tert-butyl N-methyl-N-(4-propan-2-ylphenyl)carbamate;1-tert-butyl-4-propan-2-ylbenzene;4-chloro-1-methyl-2-propan-2-ylindole;1-(difluoromethyl)-3-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;3-methyl-1-(1-methylindol-5-yl)butan-2-one;1-methyl-5-propan-2-ylindazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-[(1S)-1-phenylethyl]-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane
CID 158172283
1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;N-(3-methoxyphenyl)-2-methylpropanamide;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;3-methyl-1-(1-methylindol-5-yl)butan-2-one;1-methyl-5-propan-2-ylindazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane
CID 160552566
1-[(2R)-butan-2-yl]-3-cyclopropyl-5-propan-2-ylindazole;1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;1-tert-butyl-4-propan-2-ylpyrazole;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-[(1S)-1-phenylethyl]-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane
CID 161154670

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane?
The IUPAC name of 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane (CID 162090467) is 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane.
What is the SMILES notation for 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane?
The canonical SMILES for 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane is CC(C)/C(F)=C/c1ccc(C#N)cc1.CC(C)/C=C/c1cccc(-c2cnco2)c1.CC(C)Cn1cc(C(C)C)cn1.CC(C)c1cc2c(Cl)cccc2n1C.CC(C)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2.CC(C)c1cc2ccc(C#N)cc2n1C.CC(C)c1ccc(C(C)(C)C)cc1.CC(C)c1ccc(OCc2ccccc2)cc1.CC(C)c1cccc(CC#N)c1.CC(C)c1cnc2c(c1)ncn2COCC[Si](C)(C)C.CC(C)c1cnn(C(C)c2ccccc2)c1.CCCn1c(C(C)C)cc2ccccc21.Cc1ccc(C(C)C)cc1C.
What is the InChIKey of 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane?
The InChIKey is ZDNOGJAHPZTYBQ-VMDWJZTRSA-N. The full InChI is InChI=1S/C16H18O.C15H25N3OSi.C15H23NO2S.C14H18N2.C14H15NO.C14H19N.C13H14N2.C13H20.C12H14ClN.C12H12FN.C11H13N.C11H16.C10H18N2/c1-13(2)15-8-10-16(11-9-15)17-12-14-6-4-3-5-7-14;1-12(2)13-8-14-15(16-9-13)18(10-17-14)11-19-6-7-20(3,4)5;1-10(2)13-8-11-9-16(7-6-12(11)19-13)14(17)18-15(3,4)5;1-11(2)14-9-15-16(10-14)12(3)13-7-5-4-6-8-13;1-11(2)6-7-12-4-3-5-13(8-12)14-9-15-10-16-14;1-4-9-15-13-8-6-5-7-12(13)10-14(15)11(2)3;1-9(2)12-7-11-5-4-10(8-14)6-13(11)15(12)3;1-10(2)11-6-8-12(9-7-11)13(3,4)5;1-8(2)12-7-9-10(13)5-4-6-11(9)14(12)3;1-9(2)12(13)7-10-3-5-11(8-14)6-4-10;1-9(2)11-5-3-4-10(8-11)6-7-12;1-8(2)11-6-5-9(3)10(4)7-11;1-8(2)6-12-7-10(5-11-12)9(3)4/h3-11,13H,12H2,1-2H3;8-10,12H,6-7,11H2,1-5H3;8,10H,6-7,9H2,1-5H3;4-12H,1-3H3;3-11H,1-2H3;5-8,10-11H,4,9H2,1-3H3;4-7,9H,1-3H3;6-10H,1-5H3;4-8H,1-3H3;3-7,9H,1-2H3;3-5,8-9H,6H2,1-2H3;5-8H,1-4H3;5,7-9H,6H2,1-4H3/b;;;;7-6+;;;;;12-7-;;;.
What are the key properties of 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane?
1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane has a molecular weight of 2673.37 g/mol, XLogP of 47.95, 31 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-4-propan-2-ylbenzene;tert-butyl 2-propan-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate;4-chloro-1-methyl-2-propan-2-ylindole;1,2-dimethyl-4-propan-2-ylbenzene;4-[(Z)-2-fluoro-3-methylbut-1-enyl]benzonitrile;5-[3-[(E)-3-methylbut-1-enyl]phenyl]-1,3-oxazole;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-(2-methylpropyl)-4-propan-2-ylpyrazole;1-(1-phenylethyl)-4-propan-2-ylpyrazole;1-phenylmethoxy-4-propan-2-ylbenzene;2-(3-propan-2-ylphenyl)acetonitrile;2-propan-2-yl-1-propylindole;trimethyl-[2-[(6-propan-2-ylimidazo[4,5-b]pyridin-3-yl)methoxy]ethyl]silane is sourced from PubChem (CID 162090467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).