N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine

C9H9Br2N3 — CID 10245368

IUPACN-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESBrc1cccc(Br)c1NC1=NCCN1
InChIInChI=1S/C9H9Br2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
InChIKeyXIVCHYWIEHVAJG-UHFFFAOYSA-N
MW319.00 g/mol
LogP2.58
Rot. Bonds1

About N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine

N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 10245368) has the molecular formula C9H9Br2N3 and a molecular weight of 319.00 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID10245368
Molecular FormulaC9H9Br2N3
Molecular Weight319.00 g/mol
Exact Mass316.92
IUPAC NameN-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESBrc1cccc(Br)c1NC1=NCCN1
InChIInChI=1S/C9H9Br2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)
InChIKeyXIVCHYWIEHVAJG-UHFFFAOYSA-N
XLogP2.58
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.00
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 10245368) is N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine is Brc1cccc(Br)c1NC1=NCCN1.
What is the InChIKey of N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is XIVCHYWIEHVAJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Br2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14).
What are the key properties of N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 319.00 g/mol, XLogP of 2.58, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 10245368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).