1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine

C231H342BrN15O5 — CID 158987810

IUPAC1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
SMILESCC(=O)Cc1ccc(C(C)C)c(C(C)C)c1.CC(C)C1CCc2ccccc21.CC(C)Cc1ccco1.CC(C)c1cc[nH]c1C(C)C.CC(C)c1ccc(OCCN(C)C)cc1C(C)C.CC(C)c1cccc(C#N)c1.CC(C)c1cccc(C#N)c1C(C)C.CC(C)c1cccc2c1C=CC2.CC(C)c1ccccc1Br.CC(C)c1ccccc1C(C)O.CC(C)c1ccccc1N1CCCC1.CC(C)c1cccnc1N1CCCC1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cncn1C(C)C.CC(C)c1cnn(C(C)C)c1.CC(C)c1nc[nH]c1C(C)C.CCCOc1ccc(C(C)C)c(C(C)C)c1.CCc1cccc(CC)c1C(C)C.Cc1ccc2c(c1C(C)C)C=CC2.Cc1cccc2c1C(C(C)C)CC2
InChIInChI=1S/C16H27NO.C15H22O.C15H24O.C13H19N.C13H17N.C13H16.C13H18.C13H20.C12H18N2.C12H14.C12H16.C11H16O.C10H17N.C10H11N.C9H11Br.4C9H16N2.C8H12O/c1-12(2)15-8-7-14(11-16(15)13(3)4)18-10-9-17(5)6;1-10(2)14-7-6-13(8-12(5)16)9-15(14)11(3)4;1-6-9-16-13-7-8-14(11(2)3)15(10-13)12(4)5;1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-14;1-9(2)12-7-5-6-11(8-14)13(12)10(3)4;1-9(2)13-10(3)7-8-11-5-4-6-12(11)13;1-9(2)12-8-7-11-6-4-5-10(3)13(11)12;1-5-11-8-7-9-12(6-2)13(11)10(3)4;1-10(2)11-6-5-7-13-12(11)14-8-3-4-9-14;1-9(2)11-7-3-5-10-6-4-8-12(10)11;1-9(2)11-8-7-10-5-3-4-6-12(10)11;1-8(2)10-6-4-5-7-11(10)9(3)12;1-7(2)9-5-6-11-10(9)8(3)4;1-8(2)10-5-3-4-9(6-10)7-11;1-7(2)8-5-3-4-6-9(8)10;1-7(2)9-5-11(6-10-9)8(3)4;1-7(2)9-5-10-6-11(9)8(3)4;1-7(2)9-5-10-11(6-9)8(3)4;1-6(2)8-9(7(3)4)11-5-10-8;1-7(2)6-8-4-3-5-9-8/h7-8,11-13H,9-10H2,1-6H3;6-7,9-11H,8H2,1-5H3;7-8,10-12H,6,9H2,1-5H3;3-4,7-8,11H,5-6,9-10H2,1-2H3;5-7,9-10H,1-4H3;4,6-9H,5H2,1-3H3;4-6,9,12H,7-8H2,1-3H3;7-10H,5-6H2,1-4H3;5-7,10H,3-4,8-9H2,1-2H3;3-5,7-9H,6H2,1-2H3;3-6,9,11H,7-8H2,1-2H3;4-9,12H,1-3H3;5-8,11H,1-4H3;3-6,8H,1-2H3;3-7H,1-2H3;3*5-8H,1-4H3;5-7H,1-4H3,(H,10,11);3-5,7H,6H2,1-2H3
InChIKeyJPUBJZTWLLXIKJ-UHFFFAOYSA-N
MW3489.28 g/mol
LogP66.01
Rot. Bonds44

About 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine

1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine (PubChem CID 158987810) has the molecular formula C231H342BrN15O5 and a molecular weight of 3489.28 g/mol. Its IUPAC name is 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
PubChem CID158987810
Molecular FormulaC231H342BrN15O5
Molecular Weight3489.28 g/mol
Exact Mass3485.62
IUPAC Name1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
SMILESCC(=O)Cc1ccc(C(C)C)c(C(C)C)c1.CC(C)C1CCc2ccccc21.CC(C)Cc1ccco1.CC(C)c1cc[nH]c1C(C)C.CC(C)c1ccc(OCCN(C)C)cc1C(C)C.CC(C)c1cccc(C#N)c1.CC(C)c1cccc(C#N)c1C(C)C.CC(C)c1cccc2c1C=CC2.CC(C)c1ccccc1Br.CC(C)c1ccccc1C(C)O.CC(C)c1ccccc1N1CCCC1.CC(C)c1cccnc1N1CCCC1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cncn1C(C)C.CC(C)c1cnn(C(C)C)c1.CC(C)c1nc[nH]c1C(C)C.CCCOc1ccc(C(C)C)c(C(C)C)c1.CCc1cccc(CC)c1C(C)C.Cc1ccc2c(c1C(C)C)C=CC2.Cc1cccc2c1C(C(C)C)CC2
InChIInChI=1S/C16H27NO.C15H22O.C15H24O.C13H19N.C13H17N.C13H16.C13H18.C13H20.C12H18N2.C12H14.C12H16.C11H16O.C10H17N.C10H11N.C9H11Br.4C9H16N2.C8H12O/c1-12(2)15-8-7-14(11-16(15)13(3)4)18-10-9-17(5)6;1-10(2)14-7-6-13(8-12(5)16)9-15(14)11(3)4;1-6-9-16-13-7-8-14(11(2)3)15(10-13)12(4)5;1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-14;1-9(2)12-7-5-6-11(8-14)13(12)10(3)4;1-9(2)13-10(3)7-8-11-5-4-6-12(11)13;1-9(2)12-8-7-11-6-4-5-10(3)13(11)12;1-5-11-8-7-9-12(6-2)13(11)10(3)4;1-10(2)11-6-5-7-13-12(11)14-8-3-4-9-14;1-9(2)11-7-3-5-10-6-4-8-12(10)11;1-9(2)11-8-7-10-5-3-4-6-12(10)11;1-8(2)10-6-4-5-7-11(10)9(3)12;1-7(2)9-5-6-11-10(9)8(3)4;1-8(2)10-5-3-4-9(6-10)7-11;1-7(2)8-5-3-4-6-9(8)10;1-7(2)9-5-11(6-10-9)8(3)4;1-7(2)9-5-10-6-11(9)8(3)4;1-7(2)9-5-10-11(6-9)8(3)4;1-6(2)8-9(7(3)4)11-5-10-8;1-7(2)6-8-4-3-5-9-8/h7-8,11-13H,9-10H2,1-6H3;6-7,9-11H,8H2,1-5H3;7-8,10-12H,6,9H2,1-5H3;3-4,7-8,11H,5-6,9-10H2,1-2H3;5-7,9-10H,1-4H3;4,6-9H,5H2,1-3H3;4-6,9,12H,7-8H2,1-3H3;7-10H,5-6H2,1-4H3;5-7,10H,3-4,8-9H2,1-2H3;3-5,7-9H,6H2,1-2H3;3-6,9,11H,7-8H2,1-2H3;4-9,12H,1-3H3;5-8,11H,1-4H3;3-6,8H,1-2H3;3-7H,1-2H3;3*5-8H,1-4H3;5-7H,1-4H3,(H,10,11);3-5,7H,6H2,1-2H3
InChIKeyJPUBJZTWLLXIKJ-UHFFFAOYSA-N
XLogP66.01
TPSA237.02 Ų
H-Bond Donors3
H-Bond Acceptors18
Rotatable Bonds44
Heavy Atoms252
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003489.28
LogP ≤ 566.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1018

Analyze 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-but-3-yn-2-yl-4-methyl-1-propan-2-ylbenzene;2,4-diethyl-3-propan-2-yl-1H-pyrrole;3,3-difluoro-1-(2-propan-2-ylphenyl)pyrrolidine;2-(3,3-difluoropyrrolidin-1-yl)-3-propan-2-ylpyridine;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;1-[2,3-di(propan-2-yl)phenyl]ethanol;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;4-methyl-1,2-di(propan-2-yl)benzene;5-[1-(3-methyl-2-propan-2-ylphenyl)ethyl]-1,3-oxazole;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-(2-propan-2-ylphenyl)ethanol
CID 158314335
1-bromo-2-propan-2-ylbenzene;2-but-3-yn-2-yl-4-fluoro-1-propan-2-ylbenzene;3,3-difluoro-1-(2-propan-2-ylphenyl)pyrrolidine;2-(3,3-difluoropyrrolidin-1-yl)-3-propan-2-ylpyridine;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;bis(4,5-di(propan-2-yl)-1H-imidazole);2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;2-[3,4-di(propan-2-yl)phenyl]acetic acid;bis(1,2-di(propan-2-yl)-4-propoxybenzene);1,4-di(propan-2-yl)pyrazole;4-fluoro-1,2-di(propan-2-yl)benzene;1-[3-(1-hydroxyethyl)-2-propan-2-ylphenyl]ethanol;5-(2-methylpropyl)-1,2-oxazole;3-propan-2-ylbenzonitrile;1-(2-propan-2-ylphenyl)ethanol;5-[1-(2-propan-2-ylphenyl)ethyl]-1,3-oxazole
CID 158364601
1-bromo-2-propan-2-ylbenzene;2-but-3-yn-2-yl-4-methyl-1-propan-2-ylbenzene;3,3-difluoro-1-(2-propan-2-ylphenyl)pyrrolidine;2-(3,3-difluoropyrrolidin-1-yl)-3-propan-2-ylpyridine;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[2,3-di(propan-2-yl)phenyl]ethanol;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;3,4-di(propan-2-yl)-2H-pyrrole;4-methyl-1,2-di(propan-2-yl)benzene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-(2-propan-2-ylphenyl)ethanol;5-[1-(2-propan-2-ylphenyl)ethyl]-1,3-oxazole
CID 159305982
1-bromo-2-propan-2-ylbenzene;2-but-3-yn-2-yl-4-methyl-1-propan-2-ylbenzene;3,5-diethyl-4-propan-2-yl-1H-pyrazole;3,3-difluoro-1-(2-propan-2-ylphenyl)pyrrolidine;2-(3,3-difluoropyrrolidin-1-yl)-3-propan-2-ylpyridine;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,4-di(propan-2-yl)pyrazole;4,5-di(propan-2-yl)-1H-pyrazole;4-fluoro-1,2-di(propan-2-yl)benzene;1-[3-(1-hydroxyethyl)-2-propan-2-ylphenyl]ethanol;methane;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-(2-propan-2-ylphenyl)ethanol;5-[1-(2-propan-2-ylphenyl)ethyl]-1,3-oxazole
CID 161119492
1-bromo-2-propan-2-ylbenzene;2-but-3-yn-2-yl-4-methyl-1-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;4,5-di(propan-2-yl)-1H-pyrazole;4-methyl-1,2-di(propan-2-yl)benzene;5-methyl-4-propan-2-yl-1H-isoindole;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 157805180
1-bromo-2-propan-2-ylbenzene;2-but-3-yn-2-yl-4-methyl-1-propan-2-ylbenzene;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;1-[3-(1-hydroxyethyl)-2-propan-2-ylphenyl]ethanol;4-methyl-1,2-di(propan-2-yl)benzene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-(2-propan-2-ylphenyl)ethanol
CID 158549401
1-bromo-2-propan-2-ylbenzene;2-but-3-yn-2-yl-4-methyl-1-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;4,5-di(propan-2-yl)-1H-pyrazole;4-methyl-1,2-di(propan-2-yl)benzene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 158670803
1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;4,5-di(propan-2-yl)-1H-pyrazole;5-methyl-4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 159122403
1-bromo-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;3,4-di(propan-2-yl)-2H-pyrrole;4-methyl-1,2-di(propan-2-yl)benzene;5-(2-methylpropyl)-1,2-oxazole;3-propan-2-ylbenzonitrile;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine
CID 159183687
1-bromo-2-propan-2-ylbenzene;2-but-3-yn-2-yl-4-methyl-1-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;1,2-di(propan-2-yl)pyrrole;2,3-di(propan-2-yl)-1H-pyrrole;3,4-di(propan-2-yl)-2H-pyrrole;4-methyl-1,2-di(propan-2-yl)benzene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 159730257
1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;bis(1,4-di(propan-2-yl)pyrazole);2,3-di(propan-2-yl)-1H-pyrrole;4-methyl-1,2-di(propan-2-yl)benzene;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 160286328
1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;bis(1,2-di(propan-2-yl)-4-propoxybenzene);1,2-di(propan-2-yl)pyrrole;2,3-di(propan-2-yl)-1H-pyrrole;3,4-di(propan-2-yl)-2H-pyrrole;5-methyl-4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 162161188

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine?
The IUPAC name of 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine (CID 158987810) is 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine?
The canonical SMILES for 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine is CC(=O)Cc1ccc(C(C)C)c(C(C)C)c1.CC(C)C1CCc2ccccc21.CC(C)Cc1ccco1.CC(C)c1cc[nH]c1C(C)C.CC(C)c1ccc(OCCN(C)C)cc1C(C)C.CC(C)c1cccc(C#N)c1.CC(C)c1cccc(C#N)c1C(C)C.CC(C)c1cccc2c1C=CC2.CC(C)c1ccccc1Br.CC(C)c1ccccc1C(C)O.CC(C)c1ccccc1N1CCCC1.CC(C)c1cccnc1N1CCCC1.CC(C)c1cn(C(C)C)cn1.CC(C)c1cncn1C(C)C.CC(C)c1cnn(C(C)C)c1.CC(C)c1nc[nH]c1C(C)C.CCCOc1ccc(C(C)C)c(C(C)C)c1.CCc1cccc(CC)c1C(C)C.Cc1ccc2c(c1C(C)C)C=CC2.Cc1cccc2c1C(C(C)C)CC2.
What is the InChIKey of 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine?
The InChIKey is JPUBJZTWLLXIKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO.C15H22O.C15H24O.C13H19N.C13H17N.C13H16.C13H18.C13H20.C12H18N2.C12H14.C12H16.C11H16O.C10H17N.C10H11N.C9H11Br.4C9H16N2.C8H12O/c1-12(2)15-8-7-14(11-16(15)13(3)4)18-10-9-17(5)6;1-10(2)14-7-6-13(8-12(5)16)9-15(14)11(3)4;1-6-9-16-13-7-8-14(11(2)3)15(10-13)12(4)5;1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-14;1-9(2)12-7-5-6-11(8-14)13(12)10(3)4;1-9(2)13-10(3)7-8-11-5-4-6-12(11)13;1-9(2)12-8-7-11-6-4-5-10(3)13(11)12;1-5-11-8-7-9-12(6-2)13(11)10(3)4;1-10(2)11-6-5-7-13-12(11)14-8-3-4-9-14;1-9(2)11-7-3-5-10-6-4-8-12(10)11;1-9(2)11-8-7-10-5-3-4-6-12(10)11;1-8(2)10-6-4-5-7-11(10)9(3)12;1-7(2)9-5-6-11-10(9)8(3)4;1-8(2)10-5-3-4-9(6-10)7-11;1-7(2)8-5-3-4-6-9(8)10;1-7(2)9-5-11(6-10-9)8(3)4;1-7(2)9-5-10-6-11(9)8(3)4;1-7(2)9-5-10-11(6-9)8(3)4;1-6(2)8-9(7(3)4)11-5-10-8;1-7(2)6-8-4-3-5-9-8/h7-8,11-13H,9-10H2,1-6H3;6-7,9-11H,8H2,1-5H3;7-8,10-12H,6,9H2,1-5H3;3-4,7-8,11H,5-6,9-10H2,1-2H3;5-7,9-10H,1-4H3;4,6-9H,5H2,1-3H3;4-6,9,12H,7-8H2,1-3H3;7-10H,5-6H2,1-4H3;5-7,10H,3-4,8-9H2,1-2H3;3-5,7-9H,6H2,1-2H3;3-6,9,11H,7-8H2,1-2H3;4-9,12H,1-3H3;5-8,11H,1-4H3;3-6,8H,1-2H3;3-7H,1-2H3;3*5-8H,1-4H3;5-7H,1-4H3,(H,10,11);3-5,7H,6H2,1-2H3.
What are the key properties of 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine?
1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine has a molecular weight of 3489.28 g/mol, XLogP of 66.01, 44 rotatable bonds, 3 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-propan-2-ylbenzene;1,3-diethyl-2-propan-2-ylbenzene;2,3-di(propan-2-yl)benzonitrile;1,4-di(propan-2-yl)imidazole;1,5-di(propan-2-yl)imidazole;4,5-di(propan-2-yl)-1H-imidazole;2-[3,4-di(propan-2-yl)phenoxy]-N,N-dimethylethanamine;1-[3,4-di(propan-2-yl)phenyl]propan-2-one;1,2-di(propan-2-yl)-4-propoxybenzene;1,4-di(propan-2-yl)pyrazole;2,3-di(propan-2-yl)-1H-pyrrole;7-methyl-1-propan-2-yl-2,3-dihydro-1H-indene;5-methyl-4-propan-2-yl-1H-indene;2-(2-methylpropyl)furan;3-propan-2-ylbenzonitrile;1-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-1H-indene;1-(2-propan-2-ylphenyl)ethanol;1-(2-propan-2-ylphenyl)pyrrolidine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 158987810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).