[5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol

C10H8ClFN2O — CID 116878314

IUPAC[5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol
SMILESOCc1ncc(-c2cc(Cl)ccc2F)[nH]1
InChIInChI=1S/C10H8ClFN2O/c11-6-1-2-8(12)7(3-6)9-4-13-10(5-15)14-9/h1-4,15H,5H2,(H,13,14)
InChIKeyUKOJQOAOQNWYDW-UHFFFAOYSA-N
MW226.64 g/mol
LogP2.36
Rot. Bonds2

About [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol

[5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol (PubChem CID 116878314) has the molecular formula C10H8ClFN2O and a molecular weight of 226.64 g/mol. Its IUPAC name is [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol.

Molecular Properties

Compound Name[5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol
PubChem CID116878314
Molecular FormulaC10H8ClFN2O
Molecular Weight226.64 g/mol
Exact Mass226.03
IUPAC Name[5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol
SMILESOCc1ncc(-c2cc(Cl)ccc2F)[nH]1
InChIInChI=1S/C10H8ClFN2O/c11-6-1-2-8(12)7(3-6)9-4-13-10(5-15)14-9/h1-4,15H,5H2,(H,13,14)
InChIKeyUKOJQOAOQNWYDW-UHFFFAOYSA-N
XLogP2.36
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.64
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol?
The IUPAC name of [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol (CID 116878314) is [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol.
What is the SMILES notation for [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol?
The canonical SMILES for [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol is OCc1ncc(-c2cc(Cl)ccc2F)[nH]1.
What is the InChIKey of [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol?
The InChIKey is UKOJQOAOQNWYDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClFN2O/c11-6-1-2-8(12)7(3-6)9-4-13-10(5-15)14-9/h1-4,15H,5H2,(H,13,14).
What are the key properties of [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol?
[5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol has a molecular weight of 226.64 g/mol, XLogP of 2.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(5-chloro-2-fluorophenyl)-1H-imidazol-2-yl]methanol is sourced from PubChem (CID 116878314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).