1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine

C13H14BrN3 — CID 106578937

IUPAC1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine
SMILESCc1ccc(Br)c(-n2ccnc2NC2CC2)c1
InChIInChI=1S/C13H14BrN3/c1-9-2-5-11(14)12(8-9)17-7-6-15-13(17)16-10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,15,16)
InChIKeyHFEDVRBDUYPEIH-UHFFFAOYSA-N
MW292.18 g/mol
LogP3.52
Rot. Bonds3

About 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine

1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine (PubChem CID 106578937) has the molecular formula C13H14BrN3 and a molecular weight of 292.18 g/mol. Its IUPAC name is 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine.

Molecular Properties

Compound Name1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine
PubChem CID106578937
Molecular FormulaC13H14BrN3
Molecular Weight292.18 g/mol
Exact Mass291.04
IUPAC Name1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine
SMILESCc1ccc(Br)c(-n2ccnc2NC2CC2)c1
InChIInChI=1S/C13H14BrN3/c1-9-2-5-11(14)12(8-9)17-7-6-15-13(17)16-10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,15,16)
InChIKeyHFEDVRBDUYPEIH-UHFFFAOYSA-N
XLogP3.52
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-1-(2,5-dimethylphenyl)imidazol-2-amine
CID 106558241
1-(2-bromo-5-methylphenyl)-N-ethylimidazol-2-amine
CID 106578943
1-(5-bromo-4-fluoro-2-methylphenyl)-N-cyclopropylimidazol-2-amine
CID 107590742
1-(4-bromo-5-fluoro-2-methylphenyl)-N-cyclopentylimidazol-2-amine
CID 106582277
N-cyclopentyl-1-(3-methylphenyl)imidazol-2-amine
CID 106560185
1-(3-bromo-4-chlorophenyl)-N-cyclopropylimidazol-2-amine
CID 106576642
1-(2-bromo-4-methylphenyl)-N-phenylimidazol-2-amine
CID 106555620
1-(5-chloro-2-methylphenyl)-N-cyclohexylimidazol-2-amine
CID 106560628
1-(2-chloro-5-iodophenyl)-N-cyclopropylimidazol-2-amine
CID 114261820
N-cyclopropyl-1-(4-fluoro-2-methoxyphenyl)imidazol-2-amine
CID 106566452
1-(2,5-dimethylphenyl)-N-methylimidazol-2-amine
CID 106558210
N-cyclopentyl-1-(3,4-dimethylphenyl)imidazol-2-amine
CID 106560237

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine?
The IUPAC name of 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine (CID 106578937) is 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine.
What is the SMILES notation for 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine?
The canonical SMILES for 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine is Cc1ccc(Br)c(-n2ccnc2NC2CC2)c1.
What is the InChIKey of 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine?
The InChIKey is HFEDVRBDUYPEIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrN3/c1-9-2-5-11(14)12(8-9)17-7-6-15-13(17)16-10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,15,16).
What are the key properties of 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine?
1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine has a molecular weight of 292.18 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromo-5-methylphenyl)-N-cyclopropylimidazol-2-amine is sourced from PubChem (CID 106578937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).