N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine

C11H11BrFN3 — CID 106582320

IUPACN-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine
SMILESCc1cc(Br)c(F)cc1Nc1nccn1C
InChIInChI=1S/C11H11BrFN3/c1-7-5-8(12)9(13)6-10(7)15-11-14-3-4-16(11)2/h3-6H,1-2H3,(H,14,15)
InChIKeyUGBAIKFSWXUOMA-UHFFFAOYSA-N
MW284.13 g/mol
LogP3.37
Rot. Bonds2

About N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine

N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine (PubChem CID 106582320) has the molecular formula C11H11BrFN3 and a molecular weight of 284.13 g/mol. Its IUPAC name is N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine
PubChem CID106582320
Molecular FormulaC11H11BrFN3
Molecular Weight284.13 g/mol
Exact Mass283.01
IUPAC NameN-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine
SMILESCc1cc(Br)c(F)cc1Nc1nccn1C
InChIInChI=1S/C11H11BrFN3/c1-7-5-8(12)9(13)6-10(7)15-11-14-3-4-16(11)2/h3-6H,1-2H3,(H,14,15)
InChIKeyUGBAIKFSWXUOMA-UHFFFAOYSA-N
XLogP3.37
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 ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-3-fluorophenyl)-1-methylimidazol-2-amine
CID 106574267
N-(4-bromo-2-methylphenyl)-1-methylimidazol-2-amine
CID 106556434
N-(4-bromo-5-fluoro-2-methylphenyl)-1-(3-ethoxypropyl)imidazol-2-amine
CID 106582285
N-(2-bromo-4,6-difluorophenyl)-1-methylimidazol-2-amine
CID 106561368
N-(3-bromo-4-methylphenyl)-1-methylimidazol-2-amine
CID 106573027
N-(3-bromo-2-methylphenyl)-1-methylimidazol-2-amine
CID 107627985
N-(4-bromo-2,5-difluorophenyl)-1-ethylimidazol-2-amine
CID 107608623
N-(3-fluoro-5-methylphenyl)-1-methylimidazol-2-amine
CID 106576252
N-(4-bromo-5-fluoro-2-methylphenyl)-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106582300
1,3-dimethyl-N-(1-methylimidazol-2-yl)pyrazol-4-amine
CID 102806061
N-(4-bromo-5-fluoro-2-methylphenyl)-2-chloropyridin-4-amine
CID 102824403
4-bromo-2-N-(4-bromo-5-fluoro-2-methylphenyl)-5-fluorobenzene-1,2-diamine
CID 116736340

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine?
The IUPAC name of N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine (CID 106582320) is N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine.
What is the SMILES notation for N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine?
The canonical SMILES for N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine is Cc1cc(Br)c(F)cc1Nc1nccn1C.
What is the InChIKey of N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine?
The InChIKey is UGBAIKFSWXUOMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrFN3/c1-7-5-8(12)9(13)6-10(7)15-11-14-3-4-16(11)2/h3-6H,1-2H3,(H,14,15).
What are the key properties of N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine?
N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine has a molecular weight of 284.13 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-5-fluoro-2-methylphenyl)-1-methylimidazol-2-amine is sourced from PubChem (CID 106582320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).