5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole

C85H118Cl3N15 — CID 158918731

IUPAC5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole
SMILESCC1=C(C)N=C(C(C)C)C1.Cc1cc(C(C)C)nn1C.Cc1nc(C(C)C)c(Cl)n1-c1ccccc1.Cc1nc(C(C)C)cn1-c1ccc(Cl)cc1.Cc1nc(C(C)C)cn1-c1cccc(Cl)c1.Cc1nc(C(C)C)cn1-c1ccccc1.Cc1nc(C(C)C)cn1C.Cc1ncc(C(C)C)n1C
InChIInChI=1S/3C13H15ClN2.C13H16N2.C9H15N.3C8H14N2/c1-9(2)13-8-16(10(3)15-13)12-6-4-11(14)5-7-12;1-9(2)13-8-16(10(3)15-13)12-6-4-5-11(14)7-12;1-9(2)12-13(14)16(10(3)15-12)11-7-5-4-6-8-11;1-10(2)13-9-15(11(3)14-13)12-7-5-4-6-8-12;1-6(2)9-5-7(3)8(4)10-9;1-6(2)8-5-10(4)7(3)9-8;1-6(2)8-5-9-7(3)10(8)4;1-6(2)8-5-7(3)10(4)9-8/h3*4-9H,1-3H3;4-10H,1-3H3;6H,5H2,1-4H3;3*5-6H,1-4H3
InChIKeyJHOISIPQRSNMTD-UHFFFAOYSA-N
MW1456.34 g/mol
LogP23.51
Rot. Bonds12

About 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole

5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole (PubChem CID 158918731) has the molecular formula C85H118Cl3N15 and a molecular weight of 1456.34 g/mol. Its IUPAC name is 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole.

Molecular Properties

Compound Name5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole
PubChem CID158918731
Molecular FormulaC85H118Cl3N15
Molecular Weight1456.34 g/mol
Exact Mass1453.88
IUPAC Name5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole
SMILESCC1=C(C)N=C(C(C)C)C1.Cc1cc(C(C)C)nn1C.Cc1nc(C(C)C)c(Cl)n1-c1ccccc1.Cc1nc(C(C)C)cn1-c1ccc(Cl)cc1.Cc1nc(C(C)C)cn1-c1cccc(Cl)c1.Cc1nc(C(C)C)cn1-c1ccccc1.Cc1nc(C(C)C)cn1C.Cc1ncc(C(C)C)n1C
InChIInChI=1S/3C13H15ClN2.C13H16N2.C9H15N.3C8H14N2/c1-9(2)13-8-16(10(3)15-13)12-6-4-11(14)5-7-12;1-9(2)13-8-16(10(3)15-13)12-6-4-5-11(14)7-12;1-9(2)12-13(14)16(10(3)15-12)11-7-5-4-6-8-11;1-10(2)13-9-15(11(3)14-13)12-7-5-4-6-8-12;1-6(2)9-5-7(3)8(4)10-9;1-6(2)8-5-10(4)7(3)9-8;1-6(2)8-5-9-7(3)10(8)4;1-6(2)8-5-7(3)10(4)9-8/h3*4-9H,1-3H3;4-10H,1-3H3;6H,5H2,1-4H3;3*5-6H,1-4H3
InChIKeyJHOISIPQRSNMTD-UHFFFAOYSA-N
XLogP23.51
TPSA137.10 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds12
Heavy Atoms103
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001456.34
LogP ≤ 523.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole 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

Bis(1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-ethenylpyrazole);1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)tetrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-1,2,4-triazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-ethenyl-3-methylpyrazole;tetrakis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylpyrazole);1-(4-chloro-2-propan-2-ylphenyl)imidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylimidazole;1-(4-chloro-2-propan-2-ylphenyl)triazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)imidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 157567724
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-ethenylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 159025856
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(difluoromethyl)imidazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;tetrakis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);1-(4-chloro-2-propan-2-ylphenyl)-4-ethylimidazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-methylimidazole;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)imidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 159525162
1-[1-(4-Chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-3-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyrrolidin-2-one;1-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyrrolidin-2-one
CID 160052996
3-Tert-butyl-5-ethyl-1-phenyl-1,2,4-triazole;3-tert-butyl-1-(4-fluorophenyl)-5-methylpyrazole;3-tert-butyl-1-(2-fluorophenyl)pyrazole;3-tert-butyl-1-(3-fluorophenyl)pyrazole;3-tert-butyl-5-methoxy-1-phenyl-1,2,4-triazole;3-tert-butyl-5-methyl-1-phenylpyrazole;3-tert-butyl-1-methylpyrazole;3-tert-butyl-1-phenylpyrazole;3-tert-butyl-1-phenyl-5-(trifluoromethyl)pyrazole;3-tert-butyl-1-propan-2-ylpyrazole;1-(3-chlorophenyl)-3-propan-2-ylpyrazole;methane
CID 161232878
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 162243974
1-(4-Chloro-3-fluoro-2-propan-2-ylphenyl)-4-ethenyl-3-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-ethenylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)pyrazole-4-carbonitrile;1-(4-chloro-3-fluoro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole;1-(4-chloro-2-propan-2-ylphenyl)-3,4-dimethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)imidazole-4-carbonitrile;1-(4-chloro-2-propan-2-ylphenyl)-4-methylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-4-(trifluoromethyl)pyrazole
CID 163583697
4-(4-Chloro-2-propan-2-ylphenyl)-1-(difluoromethyl)pyrazole;bis(1-(4-chloro-2-propan-2-ylphenyl)-4-ethenylimidazole);bis(4-(4-chloro-2-propan-2-ylphenyl)-1-ethenylpyrazole);4-(4-chloro-2-propan-2-ylphenyl)-1-ethylpyrazole;1-(4-chloro-2-propan-2-ylphenyl)-5-methylimidazole;4-(4-chloro-2-propan-2-ylphenyl)-1-methylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-phenylpyrazole;4-(4-chloro-2-propan-2-ylphenyl)-1-(trifluoromethyl)pyrazole;ethane
CID 164143684
1-(4-Chlorophenyl)-4,5-diphenyl-2-(1,3-diphenyl-1h-pyrazol-4-yl)-1h-imidazole
CID 129832294
1-(4-Chlorophenyl)-4-[3-methyl-3-[2-methyl-4-(trifluoromethyl)imidazol-1-yl]pyrrolidin-1-yl]-5-propan-2-ylpyrazole
CID 152726349
5-[4-(4-Chlorophenyl)-5-(triazol-2-ylmethyl)-1,2,4-triazol-3-yl]-1-methyl-4,6-dihydropyrrolo[3,4-d]pyrazole
CID 16097640
5-[4-(4-chlorophenyl)-5-(triazol-2-ylmethyl)-1,2,4-triazol-3-yl]-2-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
CID 16097646

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole?
The IUPAC name of 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole (CID 158918731) is 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole.
What is the SMILES notation for 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole?
The canonical SMILES for 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole is CC1=C(C)N=C(C(C)C)C1.Cc1cc(C(C)C)nn1C.Cc1nc(C(C)C)c(Cl)n1-c1ccccc1.Cc1nc(C(C)C)cn1-c1ccc(Cl)cc1.Cc1nc(C(C)C)cn1-c1cccc(Cl)c1.Cc1nc(C(C)C)cn1-c1ccccc1.Cc1nc(C(C)C)cn1C.Cc1ncc(C(C)C)n1C.
What is the InChIKey of 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole?
The InChIKey is JHOISIPQRSNMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/3C13H15ClN2.C13H16N2.C9H15N.3C8H14N2/c1-9(2)13-8-16(10(3)15-13)12-6-4-11(14)5-7-12;1-9(2)13-8-16(10(3)15-13)12-6-4-5-11(14)7-12;1-9(2)12-13(14)16(10(3)15-12)11-7-5-4-6-8-11;1-10(2)13-9-15(11(3)14-13)12-7-5-4-6-8-12;1-6(2)9-5-7(3)8(4)10-9;1-6(2)8-5-10(4)7(3)9-8;1-6(2)8-5-9-7(3)10(8)4;1-6(2)8-5-7(3)10(4)9-8/h3*4-9H,1-3H3;4-10H,1-3H3;6H,5H2,1-4H3;3*5-6H,1-4H3.
What are the key properties of 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole?
5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole has a molecular weight of 1456.34 g/mol, XLogP of 23.51, 12 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methyl-1-phenyl-4-propan-2-ylimidazole;1-(3-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1-(4-chlorophenyl)-2-methyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-5-propan-2-ylimidazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,5-dimethyl-2-propan-2-yl-3H-pyrrole;2-methyl-1-phenyl-4-propan-2-ylimidazole is sourced from PubChem (CID 158918731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).