N-(2-bromophenyl)-1H-imidazol-2-amine

C9H8BrN3 — CID 10490084

IUPACN-(2-bromophenyl)-1H-imidazol-2-amine
SMILESBrc1ccccc1Nc1ncc[nH]1
InChIInChI=1S/C9H8BrN3/c10-7-3-1-2-4-8(7)13-9-11-5-6-12-9/h1-6H,(H2,11,12,13)
InChIKeyKHNAVCNEASQADL-UHFFFAOYSA-N
MW238.09 g/mol
LogP2.92
Rot. Bonds2

About N-(2-bromophenyl)-1H-imidazol-2-amine

N-(2-bromophenyl)-1H-imidazol-2-amine (PubChem CID 10490084) has the molecular formula C9H8BrN3 and a molecular weight of 238.09 g/mol. Its IUPAC name is N-(2-bromophenyl)-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2-bromophenyl)-1H-imidazol-2-amine
PubChem CID10490084
Molecular FormulaC9H8BrN3
Molecular Weight238.09 g/mol
Exact Mass236.99
IUPAC NameN-(2-bromophenyl)-1H-imidazol-2-amine
SMILESBrc1ccccc1Nc1ncc[nH]1
InChIInChI=1S/C9H8BrN3/c10-7-3-1-2-4-8(7)13-9-11-5-6-12-9/h1-6H,(H2,11,12,13)
InChIKeyKHNAVCNEASQADL-UHFFFAOYSA-N
XLogP2.92
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.09
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-1H-imidazol-2-amine?
The IUPAC name of N-(2-bromophenyl)-1H-imidazol-2-amine (CID 10490084) is N-(2-bromophenyl)-1H-imidazol-2-amine.
What is the SMILES notation for N-(2-bromophenyl)-1H-imidazol-2-amine?
The canonical SMILES for N-(2-bromophenyl)-1H-imidazol-2-amine is Brc1ccccc1Nc1ncc[nH]1.
What is the InChIKey of N-(2-bromophenyl)-1H-imidazol-2-amine?
The InChIKey is KHNAVCNEASQADL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN3/c10-7-3-1-2-4-8(7)13-9-11-5-6-12-9/h1-6H,(H2,11,12,13).
What are the key properties of N-(2-bromophenyl)-1H-imidazol-2-amine?
N-(2-bromophenyl)-1H-imidazol-2-amine has a molecular weight of 238.09 g/mol, XLogP of 2.92, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-1H-imidazol-2-amine is sourced from PubChem (CID 10490084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).