[5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine

C10H9BrFN3 — CID 83903270

IUPAC[5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine
SMILESNCc1ncc(Br)n1-c1ccccc1F
InChIInChI=1S/C10H9BrFN3/c11-9-6-14-10(5-13)15(9)8-4-2-1-3-7(8)12/h1-4,6H,5,13H2
InChIKeyOMEJEOCFBJOKKN-UHFFFAOYSA-N
MW270.10 g/mol
LogP2.23
Rot. Bonds2

About [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine

[5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine (PubChem CID 83903270) has the molecular formula C10H9BrFN3 and a molecular weight of 270.10 g/mol. Its IUPAC name is [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine.

Molecular Properties

Compound Name[5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine
PubChem CID83903270
Molecular FormulaC10H9BrFN3
Molecular Weight270.10 g/mol
Exact Mass269.00
IUPAC Name[5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine
SMILESNCc1ncc(Br)n1-c1ccccc1F
InChIInChI=1S/C10H9BrFN3/c11-9-6-14-10(5-13)15(9)8-4-2-1-3-7(8)12/h1-4,6H,5,13H2
InChIKeyOMEJEOCFBJOKKN-UHFFFAOYSA-N
XLogP2.23
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.10
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aminomethyl)-4-(2-fluorophenyl)-1H-1,2,4-triazol-5-one
CID 81488222
[1-(2-fluorophenyl)imidazol-4-yl]methanamine
CID 82468834
[2-(2-fluorophenyl)triazol-4-yl]methanamine;hydrochloride
CID 117071648
2-[4-(2-fluorophenyl)-5-methoxy-1,2,4-triazol-3-yl]ethanamine
CID 83897003
[1-(2-fluorophenyl)pyrrolo[2,3-b]pyridin-5-yl]methanamine
CID 174276964
4-(bromomethyl)-1-(2-fluorophenyl)imidazole
CID 130482556
[1-(4-fluorophenyl)-5-methylimidazol-2-yl]methanamine
CID 83882408
[5-ethyl-1-(2-fluorophenyl)triazol-4-yl]methanamine
CID 82196549
[5-ethyl-3-(2-fluorophenyl)triazol-4-yl]methanamine
CID 105475486
[1,5-bis(2-fluorophenyl)triazol-4-yl]methanamine
CID 82196565
[2-(4-bromopyrazol-1-yl)-6-fluorophenyl]methanamine
CID 79516871
[1-(2-fluorophenyl)-5-phenylpyrazol-4-yl]methanamine
CID 61368720

Frequently Asked Questions

What is the IUPAC name of [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine?
The IUPAC name of [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine (CID 83903270) is [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine.
What is the SMILES notation for [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine?
The canonical SMILES for [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine is NCc1ncc(Br)n1-c1ccccc1F.
What is the InChIKey of [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine?
The InChIKey is OMEJEOCFBJOKKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrFN3/c11-9-6-14-10(5-13)15(9)8-4-2-1-3-7(8)12/h1-4,6H,5,13H2.
What are the key properties of [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine?
[5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine has a molecular weight of 270.10 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-bromo-1-(2-fluorophenyl)imidazol-2-yl]methanamine is sourced from PubChem (CID 83903270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).