1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol

C19H19FN2O2 — CID 70526340

IUPAC1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol
SMILESCC(Cn1ccnc1)C(O)c1ccc(Oc2ccc(F)cc2)cc1
InChIInChI=1S/C19H19FN2O2/c1-14(12-22-11-10-21-13-22)19(23)15-2-6-17(7-3-15)24-18-8-4-16(20)5-9-18/h2-11,13-14,19,23H,12H2,1H3
InChIKeyINSSDOGFIBXEAN-UHFFFAOYSA-N
MW326.37 g/mol
LogP4.18
Rot. Bonds6

About 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol

1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol (PubChem CID 70526340) has the molecular formula C19H19FN2O2 and a molecular weight of 326.37 g/mol. Its IUPAC name is 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol
PubChem CID70526340
Molecular FormulaC19H19FN2O2
Molecular Weight326.37 g/mol
Exact Mass326.14
IUPAC Name1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol
SMILESCC(Cn1ccnc1)C(O)c1ccc(Oc2ccc(F)cc2)cc1
InChIInChI=1S/C19H19FN2O2/c1-14(12-22-11-10-21-13-22)19(23)15-2-6-17(7-3-15)24-18-8-4-16(20)5-9-18/h2-11,13-14,19,23H,12H2,1H3
InChIKeyINSSDOGFIBXEAN-UHFFFAOYSA-N
XLogP4.18
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluorophenyl)-2-imidazol-1-ylethanamine
CID 16787972
1-[2-(4-fluorophenyl)-2-phenylethyl]imidazole
CID 14211259
1-(2,3-dimethylpentyl)imidazole
CID 91321632
1-(4-fluorophenyl)-N-(1-imidazol-1-ylpropan-2-yl)propan-1-amine
CID 43749780
1-[2-(4-tert-butylphenyl)-4-(4-fluorophenoxy)butyl]imidazole
CID 170562612
2-imidazol-1-yl-1-(4-propan-2-yloxyphenyl)ethanamine
CID 16786819
N-[1-(4-fluorophenyl)-2-imidazol-1-ylethyl]-2-methylbut-3-en-1-amine
CID 166310142
1-[4-(3-imidazol-1-ylpropoxy)phenyl]ethanol
CID 54961343
1-[4-(2,4-dichlorophenoxy)phenyl]-2-imidazol-1-ylethanol
CID 20525170
1-[4-(3-chlorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-one
CID 70525728
1-[2-(4-fluorophenoxy)propyl]-3-(2-imidazol-1-ylethyl)-2-methylguanidine
CID 111678546
dihydroxy(oxo)azanium;1-[2-(4-fluorophenyl)decyl]imidazole
CID 6333710

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol?
The IUPAC name of 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol (CID 70526340) is 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol.
What is the SMILES notation for 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol?
The canonical SMILES for 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol is CC(Cn1ccnc1)C(O)c1ccc(Oc2ccc(F)cc2)cc1.
What is the InChIKey of 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol?
The InChIKey is INSSDOGFIBXEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O2/c1-14(12-22-11-10-21-13-22)19(23)15-2-6-17(7-3-15)24-18-8-4-16(20)5-9-18/h2-11,13-14,19,23H,12H2,1H3.
What are the key properties of 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol?
1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol has a molecular weight of 326.37 g/mol, XLogP of 4.18, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-fluorophenoxy)phenyl]-3-imidazol-1-yl-2-methylpropan-1-ol is sourced from PubChem (CID 70526340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).