4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol

C20H16FN3O — CID 135770653

IUPAC4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol
SMILESOc1ccc(C2=NC(c3ccc(F)cc3)C(c3ccncc3)N2)cc1
InChIInChI=1S/C20H16FN3O/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(25)8-4-15/h1-12,18-19,25H,(H,23,24)
InChIKeyLNJFDGKUWMBGPJ-UHFFFAOYSA-N
MW333.37 g/mol
LogP3.76
Rot. Bonds3

About 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol

4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol (PubChem CID 135770653) has the molecular formula C20H16FN3O and a molecular weight of 333.37 g/mol. Its IUPAC name is 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol.

Molecular Properties

Compound Name4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol
PubChem CID135770653
Molecular FormulaC20H16FN3O
Molecular Weight333.37 g/mol
Exact Mass333.13
IUPAC Name4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol
SMILESOc1ccc(C2=NC(c3ccc(F)cc3)C(c3ccncc3)N2)cc1
InChIInChI=1S/C20H16FN3O/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(25)8-4-15/h1-12,18-19,25H,(H,23,24)
InChIKeyLNJFDGKUWMBGPJ-UHFFFAOYSA-N
XLogP3.76
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.37
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol?
The IUPAC name of 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol (CID 135770653) is 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol.
What is the SMILES notation for 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol?
The canonical SMILES for 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol is Oc1ccc(C2=NC(c3ccc(F)cc3)C(c3ccncc3)N2)cc1.
What is the InChIKey of 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol?
The InChIKey is LNJFDGKUWMBGPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3O/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(25)8-4-15/h1-12,18-19,25H,(H,23,24).
What are the key properties of 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol?
4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol has a molecular weight of 333.37 g/mol, XLogP of 3.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-fluorophenyl)-5-pyridin-4-yl-4,5-dihydro-1H-imidazol-2-yl]phenol is sourced from PubChem (CID 135770653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).