5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole

C19H15F7N2O — CID 10159084

IUPAC5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole
SMILESFc1ccc(C2(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CN=CN2)cc1
InChIInChI=1S/C19H15F7N2O/c20-16-3-1-13(2-4-16)17(9-27-11-28-17)10-29-8-12-5-14(18(21,22)23)7-15(6-12)19(24,25)26/h1-7,11H,8-10H2,(H,27,28)
InChIKeySLDANWOONRFVFW-UHFFFAOYSA-N
MW420.33 g/mol
LogP4.91
Rot. Bonds5

About 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole

5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole (PubChem CID 10159084) has the molecular formula C19H15F7N2O and a molecular weight of 420.33 g/mol. Its IUPAC name is 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole.

Molecular Properties

Compound Name5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole
PubChem CID10159084
Molecular FormulaC19H15F7N2O
Molecular Weight420.33 g/mol
Exact Mass420.11
IUPAC Name5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole
SMILESFc1ccc(C2(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CN=CN2)cc1
InChIInChI=1S/C19H15F7N2O/c20-16-3-1-13(2-4-16)17(9-27-11-28-17)10-29-8-12-5-14(18(21,22)23)7-15(6-12)19(24,25)26/h1-7,11H,8-10H2,(H,27,28)
InChIKeySLDANWOONRFVFW-UHFFFAOYSA-N
XLogP4.91
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.33
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole 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

N-((3S,6S)-6-(((R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)methyl)-6-phenylpiperidin-3-yl)-4,5-dihydrooxazol-2-amine
CID 52940937
2-({[3,5-Bis(trifluoromethyl)phenyl]methoxy}methyl)-2-phenylpiperidine
CID 44346206
4-((3,5-Bis(trifluoromethyl)benzyloxy)methyl)-4-(4-fluorophenyl)imidazolidin-2-one
CID 9824321
(R)-4-((3,5-bis(trifluoromethyl)benzyloxy)methyl)-4-phenylimidazolidin-2-one
CID 10295489
1-[2-[[3,5-Bis(trifluoromethyl)phenyl]methoxy]-1-(4-fluorophenyl)ethyl]piperazine
CID 44338510
1-[2-[[3-Fluoro-5-(trifluoromethyl)phenyl]methoxy]-1-phenylethyl]piperazine
CID 44338546
1-[2-[[3,5-Bis(trifluoromethyl)phenyl]methoxy]-1-(2,3-difluorophenyl)ethyl]piperazine
CID 44338583
1-[2-[[3,5-Bis(trifluoromethyl)phenyl]methoxy]-1-(2-fluorophenyl)ethyl]piperazine
CID 44338618
1-[2-[[3,5-Bis(trifluoromethyl)phenyl]methoxy]-1-(3-fluorophenyl)ethyl]piperazine
CID 44358318
(S)-4-((3,5-bis(trifluoromethyl)benzyloxy)methyl)-4-(4-fluorophenyl)imidazolidin-2-one
CID 44407932
(R)-4-((3,5-bis(trifluoromethyl)benzyloxy)methyl)-4-(4-fluorophenyl)imidazolidin-2-one
CID 44408062
(R)-2-(3,5-Bis-trifluoromethyl-benzyloxymethyl)-2-phenyl-piperidine
CID 10047567

Frequently Asked Questions

What is the IUPAC name of 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole?
The IUPAC name of 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole (CID 10159084) is 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole.
What is the SMILES notation for 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole?
The canonical SMILES for 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole is Fc1ccc(C2(COCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CN=CN2)cc1.
What is the InChIKey of 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole?
The InChIKey is SLDANWOONRFVFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F7N2O/c20-16-3-1-13(2-4-16)17(9-27-11-28-17)10-29-8-12-5-14(18(21,22)23)7-15(6-12)19(24,25)26/h1-7,11H,8-10H2,(H,27,28).
What are the key properties of 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole?
5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole has a molecular weight of 420.33 g/mol, XLogP of 4.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-5-(4-fluorophenyl)-1,4-dihydroimidazole is sourced from PubChem (CID 10159084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).