[2-(4-bromophenyl)-1H-imidazol-5-yl]methanol

C10H9BrN2O — CID 63108219

IUPAC[2-(4-bromophenyl)-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(-c2ccc(Br)cc2)[nH]1
InChIInChI=1S/C10H9BrN2O/c11-8-3-1-7(2-4-8)10-12-5-9(6-14)13-10/h1-5,14H,6H2,(H,12,13)
InChIKeyUEFYFDAQAJTMED-UHFFFAOYSA-N
MW253.10 g/mol
LogP2.33
Rot. Bonds2

About [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol

[2-(4-bromophenyl)-1H-imidazol-5-yl]methanol (PubChem CID 63108219) has the molecular formula C10H9BrN2O and a molecular weight of 253.10 g/mol. Its IUPAC name is [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(4-bromophenyl)-1H-imidazol-5-yl]methanol
PubChem CID63108219
Molecular FormulaC10H9BrN2O
Molecular Weight253.10 g/mol
Exact Mass251.99
IUPAC Name[2-(4-bromophenyl)-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(-c2ccc(Br)cc2)[nH]1
InChIInChI=1S/C10H9BrN2O/c11-8-3-1-7(2-4-8)10-12-5-9(6-14)13-10/h1-5,14H,6H2,(H,12,13)
InChIKeyUEFYFDAQAJTMED-UHFFFAOYSA-N
XLogP2.33
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.10
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol?
The IUPAC name of [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol (CID 63108219) is [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol?
The canonical SMILES for [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol is OCc1cnc(-c2ccc(Br)cc2)[nH]1.
What is the InChIKey of [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol?
The InChIKey is UEFYFDAQAJTMED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2O/c11-8-3-1-7(2-4-8)10-12-5-9(6-14)13-10/h1-5,14H,6H2,(H,12,13).
What are the key properties of [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol?
[2-(4-bromophenyl)-1H-imidazol-5-yl]methanol has a molecular weight of 253.10 g/mol, XLogP of 2.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromophenyl)-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 63108219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).