2-bromo-1-methylimidazo[4,5-c]pyridine

C7H6BrN3 — CID 83835190

IUPAC2-bromo-1-methylimidazo[4,5-c]pyridine
SMILESCn1c(Br)nc2cnccc21
InChIInChI=1S/C7H6BrN3/c1-11-6-2-3-9-4-5(6)10-7(11)8/h2-4H,1H3
InChIKeyQWKFODNPTVNNLP-UHFFFAOYSA-N
MW212.05 g/mol
LogP1.73
Rot. Bonds

About 2-bromo-1-methylimidazo[4,5-c]pyridine

2-bromo-1-methylimidazo[4,5-c]pyridine (PubChem CID 83835190) has the molecular formula C7H6BrN3 and a molecular weight of 212.05 g/mol. Its IUPAC name is 2-bromo-1-methylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-bromo-1-methylimidazo[4,5-c]pyridine
PubChem CID83835190
Molecular FormulaC7H6BrN3
Molecular Weight212.05 g/mol
Exact Mass210.97
IUPAC Name2-bromo-1-methylimidazo[4,5-c]pyridine
SMILESCn1c(Br)nc2cnccc21
InChIInChI=1S/C7H6BrN3/c1-11-6-2-3-9-4-5(6)10-7(11)8/h2-4H,1H3
InChIKeyQWKFODNPTVNNLP-UHFFFAOYSA-N
XLogP1.73
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.05
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 327951
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CID 577022
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CID 786430
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CID 9227
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CID 274090
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Frequently Asked Questions

What is the IUPAC name of 2-bromo-1-methylimidazo[4,5-c]pyridine?
The IUPAC name of 2-bromo-1-methylimidazo[4,5-c]pyridine (CID 83835190) is 2-bromo-1-methylimidazo[4,5-c]pyridine.
What is the SMILES notation for 2-bromo-1-methylimidazo[4,5-c]pyridine?
The canonical SMILES for 2-bromo-1-methylimidazo[4,5-c]pyridine is Cn1c(Br)nc2cnccc21.
What is the InChIKey of 2-bromo-1-methylimidazo[4,5-c]pyridine?
The InChIKey is QWKFODNPTVNNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3/c1-11-6-2-3-9-4-5(6)10-7(11)8/h2-4H,1H3.
What are the key properties of 2-bromo-1-methylimidazo[4,5-c]pyridine?
2-bromo-1-methylimidazo[4,5-c]pyridine has a molecular weight of 212.05 g/mol, XLogP of 1.73, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-1-methylimidazo[4,5-c]pyridine is sourced from PubChem (CID 83835190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).