1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine

C12H11Br2N3 — CID 106566388

IUPAC1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine
SMILESBrc1ccc(Br)c(Nc2nccn2C2CC2)c1
InChIInChI=1S/C12H11Br2N3/c13-8-1-4-10(14)11(7-8)16-12-15-5-6-17(12)9-2-3-9/h1,4-7,9H,2-3H2,(H,15,16)
InChIKeyQRAJACWCNJXPLV-UHFFFAOYSA-N
MW357.05 g/mol
LogP4.49
Rot. Bonds3

About 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine

1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine (PubChem CID 106566388) has the molecular formula C12H11Br2N3 and a molecular weight of 357.05 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine
PubChem CID106566388
Molecular FormulaC12H11Br2N3
Molecular Weight357.05 g/mol
Exact Mass354.93
IUPAC Name1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine
SMILESBrc1ccc(Br)c(Nc2nccn2C2CC2)c1
InChIInChI=1S/C12H11Br2N3/c13-8-1-4-10(14)11(7-8)16-12-15-5-6-17(12)9-2-3-9/h1,4-7,9H,2-3H2,(H,15,16)
InChIKeyQRAJACWCNJXPLV-UHFFFAOYSA-N
XLogP4.49
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.05
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine?
The IUPAC name of 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine (CID 106566388) is 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine?
The canonical SMILES for 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine is Brc1ccc(Br)c(Nc2nccn2C2CC2)c1.
What is the InChIKey of 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine?
The InChIKey is QRAJACWCNJXPLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Br2N3/c13-8-1-4-10(14)11(7-8)16-12-15-5-6-17(12)9-2-3-9/h1,4-7,9H,2-3H2,(H,15,16).
What are the key properties of 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine?
1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine has a molecular weight of 357.05 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2,5-dibromophenyl)imidazol-2-amine is sourced from PubChem (CID 106566388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).