5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole

C124H108Cl4F6N8 — CID 161178222

IUPAC5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole
SMILESC.Cc1c(Cl)cccc1C(C1=CCC=N1)c1ccccc1.Cc1cccc(C(C2=CCC=N2)c2ccccc2)c1C.Cc1ccccc1C(C1=CCC=N1)c1ccccc1.Clc1cccc(C(C2=CCC=N2)c2ccccc2)c1Cl.Fc1c(C(C2=CCC=N2)c2ccccc2)cccc1C(F)(F)F.Fc1c(Cl)cccc1C(c1ccccc1)c1cnc[nH]1.Fc1cccc(C(C2=CCC=N2)c2ccccc2)c1
InChIInChI=1S/C19H19N.C18H16ClN.C18H13F4N.C18H17N.C17H13Cl2N.C17H14FN.C16H12ClFN2.CH4/c1-14-8-6-11-17(15(14)2)19(18-12-7-13-20-18)16-9-4-3-5-10-16;1-13-15(9-5-10-16(13)19)18(17-11-6-12-20-17)14-7-3-2-4-8-14;19-17-13(8-4-9-14(17)18(20,21)22)16(15-10-5-11-23-15)12-6-2-1-3-7-12;1-14-8-5-6-11-16(14)18(17-12-7-13-19-17)15-9-3-2-4-10-15;18-14-9-4-8-13(17(14)19)16(15-10-5-11-20-15)12-6-2-1-3-7-12;18-15-9-4-8-14(12-15)17(16-10-5-11-19-16)13-6-2-1-3-7-13;17-13-8-4-7-12(16(13)18)15(14-9-19-10-20-14)11-5-2-1-3-6-11;/h3-6,8-13,19H,7H2,1-2H3;2-5,7-12,18H,6H2,1H3;1-4,6-11,16H,5H2;2-6,8-13,18H,7H2,1H3;1-4,6-11,16H,5H2;1-4,6-12,17H,5H2;1-10,15H,(H,19,20);1H4
InChIKeyUSCFPWGFZSWWIB-UHFFFAOYSA-N
MW1966.08 g/mol
LogP34.57
Rot. Bonds21

About 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole

5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole (PubChem CID 161178222) has the molecular formula C124H108Cl4F6N8 and a molecular weight of 1966.08 g/mol. Its IUPAC name is 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole.

Molecular Properties

Compound Name5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole
PubChem CID161178222
Molecular FormulaC124H108Cl4F6N8
Molecular Weight1966.08 g/mol
Exact Mass1962.74
IUPAC Name5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole
SMILESC.Cc1c(Cl)cccc1C(C1=CCC=N1)c1ccccc1.Cc1cccc(C(C2=CCC=N2)c2ccccc2)c1C.Cc1ccccc1C(C1=CCC=N1)c1ccccc1.Clc1cccc(C(C2=CCC=N2)c2ccccc2)c1Cl.Fc1c(C(C2=CCC=N2)c2ccccc2)cccc1C(F)(F)F.Fc1c(Cl)cccc1C(c1ccccc1)c1cnc[nH]1.Fc1cccc(C(C2=CCC=N2)c2ccccc2)c1
InChIInChI=1S/C19H19N.C18H16ClN.C18H13F4N.C18H17N.C17H13Cl2N.C17H14FN.C16H12ClFN2.CH4/c1-14-8-6-11-17(15(14)2)19(18-12-7-13-20-18)16-9-4-3-5-10-16;1-13-15(9-5-10-16(13)19)18(17-11-6-12-20-17)14-7-3-2-4-8-14;19-17-13(8-4-9-14(17)18(20,21)22)16(15-10-5-11-23-15)12-6-2-1-3-7-12;1-14-8-5-6-11-16(14)18(17-12-7-13-19-17)15-9-3-2-4-10-15;18-14-9-4-8-13(17(14)19)16(15-10-5-11-20-15)12-6-2-1-3-7-12;18-15-9-4-8-14(12-15)17(16-10-5-11-19-16)13-6-2-1-3-7-13;17-13-8-4-7-12(16(13)18)15(14-9-19-10-20-14)11-5-2-1-3-6-11;/h3-6,8-13,19H,7H2,1-2H3;2-5,7-12,18H,6H2,1H3;1-4,6-11,16H,5H2;2-6,8-13,18H,7H2,1H3;1-4,6-11,16H,5H2;1-4,6-12,17H,5H2;1-10,15H,(H,19,20);1H4
InChIKeyUSCFPWGFZSWWIB-UHFFFAOYSA-N
XLogP34.57
TPSA102.84 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds21
Heavy Atoms142
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001966.08
LogP ≤ 534.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole 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

5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-1H-imidazole;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;5-[(2,3-difluorophenyl)-phenylmethyl]-1H-imidazole;5-[(2,3-dimethylphenyl)-phenylmethyl]-1H-imidazole;5-[(3-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-1H-imidazole;5-[(2-methylphenyl)-phenylmethyl]-1H-imidazole
CID 157412552
5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-1H-imidazole;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;5-[(2,3-difluorophenyl)-phenylmethyl]-1H-imidazole;5-[(2,3-dimethylphenyl)-phenylmethyl]-1H-imidazole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-1H-imidazole
CID 159206675
5-[(2-chloro-6-fluorophenyl)methyl]-1H-imidazole;5-[(2-ethyl-6-methylphenyl)methyl]-1H-imidazole
CID 69119095
5-[(2-chloro-6-fluorophenyl)methyl]-1H-imidazole;5-[(2,3-dimethylphenyl)methyl]-1H-imidazole
CID 157624945
5-[(Z)-1-(3-chlorophenyl)-2-phenylethenyl]-1H-imidazole;5-[1-(2,3-dichlorophenyl)-2-phenylethyl]-1H-imidazole;5-[1-(2,3-difluorophenyl)-2-phenylethyl]-1H-imidazole;5-[1-(2,3-dimethylphenyl)-2-phenylethyl]-1H-imidazole;5-(1,2-diphenylethyl)-1H-imidazole;5-[1-(2-fluorophenyl)-2-phenylethyl]-1H-imidazole;4-[1-(1H-imidazol-5-yl)-2-phenylethyl]pyridine;5-[1-(2-methylphenyl)-2-phenylethyl]-1H-imidazole
CID 158990998
5-[(Z)-1-(3-chlorophenyl)-2-phenylethenyl]-1H-imidazole;5-[1-(2,3-dichlorophenyl)-2-phenylethyl]-1H-imidazole;5-[1-(2,3-dimethylphenyl)-2-phenylethyl]-1H-imidazole;5-(1,2-diphenylethyl)-1H-imidazole;4-[1-(1H-imidazol-5-yl)-2-phenylethyl]pyridine;5-[1-(2-methylphenyl)-2-phenylethyl]-1H-imidazole
CID 159924051
4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole
CID 160970081
5-(5-chloro-1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazole;5-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazole
CID 161799606

Frequently Asked Questions

What is the IUPAC name of 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole?
The IUPAC name of 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole (CID 161178222) is 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole.
What is the SMILES notation for 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole?
The canonical SMILES for 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole is C.Cc1c(Cl)cccc1C(C1=CCC=N1)c1ccccc1.Cc1cccc(C(C2=CCC=N2)c2ccccc2)c1C.Cc1ccccc1C(C1=CCC=N1)c1ccccc1.Clc1cccc(C(C2=CCC=N2)c2ccccc2)c1Cl.Fc1c(C(C2=CCC=N2)c2ccccc2)cccc1C(F)(F)F.Fc1c(Cl)cccc1C(c1ccccc1)c1cnc[nH]1.Fc1cccc(C(C2=CCC=N2)c2ccccc2)c1.
What is the InChIKey of 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole?
The InChIKey is USCFPWGFZSWWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N.C18H16ClN.C18H13F4N.C18H17N.C17H13Cl2N.C17H14FN.C16H12ClFN2.CH4/c1-14-8-6-11-17(15(14)2)19(18-12-7-13-20-18)16-9-4-3-5-10-16;1-13-15(9-5-10-16(13)19)18(17-11-6-12-20-17)14-7-3-2-4-8-14;19-17-13(8-4-9-14(17)18(20,21)22)16(15-10-5-11-23-15)12-6-2-1-3-7-12;1-14-8-5-6-11-16(14)18(17-12-7-13-19-17)15-9-3-2-4-10-15;18-14-9-4-8-13(17(14)19)16(15-10-5-11-20-15)12-6-2-1-3-7-12;18-15-9-4-8-14(12-15)17(16-10-5-11-19-16)13-6-2-1-3-7-13;17-13-8-4-7-12(16(13)18)15(14-9-19-10-20-14)11-5-2-1-3-6-11;/h3-6,8-13,19H,7H2,1-2H3;2-5,7-12,18H,6H2,1H3;1-4,6-11,16H,5H2;2-6,8-13,18H,7H2,1H3;1-4,6-11,16H,5H2;1-4,6-12,17H,5H2;1-10,15H,(H,19,20);1H4.
What are the key properties of 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole?
5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole has a molecular weight of 1966.08 g/mol, XLogP of 34.57, 21 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-chloro-2-fluorophenyl)-phenylmethyl]-1H-imidazole;5-[(3-chloro-2-methylphenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dichlorophenyl)-phenylmethyl]-3H-pyrrole;5-[(2,3-dimethylphenyl)-phenylmethyl]-3H-pyrrole;5-[(3-fluorophenyl)-phenylmethyl]-3H-pyrrole;5-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]-3H-pyrrole;methane;5-[(2-methylphenyl)-phenylmethyl]-3H-pyrrole is sourced from PubChem (CID 161178222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).