2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole

C21H20ClFN2O2 — CID 154566107

IUPAC2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole
SMILESFc1cccc(Cl)c1COc1cccc(-c2nccn2C2CCOCC2)c1
InChIInChI=1S/C21H20ClFN2O2/c22-19-5-2-6-20(23)18(19)14-27-17-4-1-3-15(13-17)21-24-9-10-25(21)16-7-11-26-12-8-16/h1-6,9-10,13,16H,7-8,11-12,14H2
InChIKeyMUUOVKGTIZYVAG-UHFFFAOYSA-N
MW386.85 g/mol
LogP5.27
Rot. Bonds5

About 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole

2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole (PubChem CID 154566107) has the molecular formula C21H20ClFN2O2 and a molecular weight of 386.85 g/mol. Its IUPAC name is 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole.

Molecular Properties

Compound Name2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole
PubChem CID154566107
Molecular FormulaC21H20ClFN2O2
Molecular Weight386.85 g/mol
Exact Mass386.12
IUPAC Name2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole
SMILESFc1cccc(Cl)c1COc1cccc(-c2nccn2C2CCOCC2)c1
InChIInChI=1S/C21H20ClFN2O2/c22-19-5-2-6-20(23)18(19)14-27-17-4-1-3-15(13-17)21-24-9-10-25(21)16-7-11-26-12-8-16/h1-6,9-10,13,16H,7-8,11-12,14H2
InChIKeyMUUOVKGTIZYVAG-UHFFFAOYSA-N
XLogP5.27
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.85
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole 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

1-chloro-3-fluoro-2-[(3-methylphenoxy)methyl]benzene
CID 60627894
[3-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-iodophenyl)methanone
CID 4314665
7-[(2-chloro-6-fluorophenyl)methoxy]naphthalen-2-ol
CID 63549722
5-[(2-chloro-6-fluorophenyl)methoxy]-2-methylaniline
CID 39365275
3-chloro-4-[1-(oxolan-3-yl)imidazol-2-yl]pyridine
CID 154819013
(1R)-1-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-2,2,2-trifluoroethanamine
CID 66510475
N-[(2-chloro-6-fluorophenyl)methyl]-N-[(1-cyclopropylimidazol-2-yl)methyl]ethanamine
CID 91833064
4-[1-chloro-2-(2-chloro-6-fluorophenyl)ethyl]oxane
CID 63016065
(1S,5R)-7-[[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methyl]-3-oxa-7,9-diazabicyclo[3.3.2]decan-10-one
CID 155910897
1-[3-[(2-chloro-6-fluorophenyl)methoxy]benzenecarbothioyl]piperidine-4-carboxamide
CID 126202313
4-[1-[(2-chloro-6-fluorophenyl)methyl]piperidin-4-yl]morpholine
CID 171691361
N-[[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylidene]hydroxylamine
CID 20989770

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole?
The IUPAC name of 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole (CID 154566107) is 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole.
What is the SMILES notation for 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole?
The canonical SMILES for 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole is Fc1cccc(Cl)c1COc1cccc(-c2nccn2C2CCOCC2)c1.
What is the InChIKey of 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole?
The InChIKey is MUUOVKGTIZYVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20ClFN2O2/c22-19-5-2-6-20(23)18(19)14-27-17-4-1-3-15(13-17)21-24-9-10-25(21)16-7-11-26-12-8-16/h1-6,9-10,13,16H,7-8,11-12,14H2.
What are the key properties of 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole?
2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole has a molecular weight of 386.85 g/mol, XLogP of 5.27, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-1-(oxan-4-yl)imidazole is sourced from PubChem (CID 154566107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).