1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine

C11H11BrFN3 — CID 106560683

IUPAC1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine
SMILESCNc1nc(C)cn1-c1ccc(F)cc1Br
InChIInChI=1S/C11H11BrFN3/c1-7-6-16(11(14-2)15-7)10-4-3-8(13)5-9(10)12/h3-6H,1-2H3,(H,14,15)
InChIKeyOZYQLRSDPVZPPU-UHFFFAOYSA-N
MW284.13 g/mol
LogP3.12
Rot. Bonds2

About 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine

1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine (PubChem CID 106560683) has the molecular formula C11H11BrFN3 and a molecular weight of 284.13 g/mol. Its IUPAC name is 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine.

Molecular Properties

Compound Name1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine
PubChem CID106560683
Molecular FormulaC11H11BrFN3
Molecular Weight284.13 g/mol
Exact Mass283.01
IUPAC Name1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine
SMILESCNc1nc(C)cn1-c1ccc(F)cc1Br
InChIInChI=1S/C11H11BrFN3/c1-7-6-16(11(14-2)15-7)10-4-3-8(13)5-9(10)12/h3-6H,1-2H3,(H,14,15)
InChIKeyOZYQLRSDPVZPPU-UHFFFAOYSA-N
XLogP3.12
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.13
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-bromo-5-fluorophenyl)-N-ethyl-4-methylimidazol-2-amine
CID 107628425
1-(2,5-dimethylphenyl)-N,4-dimethylimidazol-2-amine
CID 106558212
N,4-dimethyl-1-(2-methylsulfanylphenyl)imidazol-2-amine
CID 107647486
1-(2-bromo-4-methylphenyl)-4-methyl-N-phenylimidazol-2-amine
CID 106555622
1-(2-bromo-4-fluorophenyl)-N-ethylimidazol-2-amine
CID 106560730
1-(3-chloro-5-fluorophenyl)-N,4-dimethylimidazol-2-amine
CID 107371340
5-(2-bromo-4-fluorophenyl)-N,4-dimethyl-1,2,4-triazol-3-amine
CID 112596472
1-[2-chloro-5-(trifluoromethyl)phenyl]-N,4-dimethylimidazol-2-amine
CID 106557943
1-(2,5-difluorophenyl)-4-methyl-N-propylimidazol-2-amine
CID 106556858
1-(3,5-dichloro-4-fluorophenyl)-N,4-dimethylimidazol-2-amine
CID 107581408
1-(2-methoxy-5-methylphenyl)-N,4-dimethylimidazol-2-amine
CID 106557791
1-(4-chloro-3-fluorophenyl)-N,4-dimethylimidazol-2-amine
CID 106567668

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine?
The IUPAC name of 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine (CID 106560683) is 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine.
What is the SMILES notation for 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine?
The canonical SMILES for 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine is CNc1nc(C)cn1-c1ccc(F)cc1Br.
What is the InChIKey of 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine?
The InChIKey is OZYQLRSDPVZPPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrFN3/c1-7-6-16(11(14-2)15-7)10-4-3-8(13)5-9(10)12/h3-6H,1-2H3,(H,14,15).
What are the key properties of 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine?
1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine has a molecular weight of 284.13 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromo-4-fluorophenyl)-N,4-dimethylimidazol-2-amine is sourced from PubChem (CID 106560683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).