2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide

C8H7Br2IN2 — CID 135397575

IUPAC2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide
SMILESBr.BrCc1cn2ccc(I)cc2n1
InChIInChI=1S/C8H6BrIN2.BrH/c9-4-7-5-12-2-1-6(10)3-8(12)11-7;/h1-3,5H,4H2;1H
InChIKeyABQVIRKQXNTSFL-UHFFFAOYSA-N
MW417.87 g/mol
LogP3.41
Rot. Bonds1

About 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide

2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide (PubChem CID 135397575) has the molecular formula C8H7Br2IN2 and a molecular weight of 417.87 g/mol. Its IUPAC name is 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide.

Molecular Properties

Compound Name2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide
PubChem CID135397575
Molecular FormulaC8H7Br2IN2
Molecular Weight417.87 g/mol
Exact Mass415.80
IUPAC Name2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide
SMILESBr.BrCc1cn2ccc(I)cc2n1
InChIInChI=1S/C8H6BrIN2.BrH/c9-4-7-5-12-2-1-6(10)3-8(12)11-7;/h1-3,5H,4H2;1H
InChIKeyABQVIRKQXNTSFL-UHFFFAOYSA-N
XLogP3.41
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.87
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

7-iodoimidazo[1,2-a]pyridin-2-amine
CID 131699714
2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde
CID 83898362
[2-(hydroxymethyl)imidazo[1,2-a]pyridin-7-yl]boronic acid
CID 170984913
2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117135256
4-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]phenol
CID 117135218
2-(7-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile
CID 82055270
2-(methylaminomethyl)imidazo[1,2-a]pyridin-7-amine
CID 117256321
[2-(2-methylpropyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117135250
7-chloro-2-(ethoxymethyl)imidazo[1,2-a]pyridine
CID 123431873
N-[(7-bromoimidazo[1,2-a]pyridin-2-yl)methyl]cyclopropanamine
CID 117256313
2-[(2-bromophenyl)methyl]-7-methylimidazo[1,2-a]pyridine
CID 117135086
2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetohydrazide
CID 82529989

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide?
The IUPAC name of 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide (CID 135397575) is 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide.
What is the SMILES notation for 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide?
The canonical SMILES for 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide is Br.BrCc1cn2ccc(I)cc2n1.
What is the InChIKey of 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide?
The InChIKey is ABQVIRKQXNTSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrIN2.BrH/c9-4-7-5-12-2-1-6(10)3-8(12)11-7;/h1-3,5H,4H2;1H.
What are the key properties of 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide?
2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide has a molecular weight of 417.87 g/mol, XLogP of 3.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide is sourced from PubChem (CID 135397575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).