7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine

C9H10BrN3 — CID 10847619

IUPAC7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine
SMILESCc1nc(C)c2ncn(C)c2c1Br
InChIInChI=1S/C9H10BrN3/c1-5-7(10)9-8(6(2)12-5)11-4-13(9)3/h4H,1-3H3
InChIKeyRJMLVTBVKQIGKD-UHFFFAOYSA-N
MW240.10 g/mol
LogP2.35
Rot. Bonds

About 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine

7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine (PubChem CID 10847619) has the molecular formula C9H10BrN3 and a molecular weight of 240.10 g/mol. Its IUPAC name is 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine
PubChem CID10847619
Molecular FormulaC9H10BrN3
Molecular Weight240.10 g/mol
Exact Mass239.01
IUPAC Name7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine
SMILESCc1nc(C)c2ncn(C)c2c1Br
InChIInChI=1S/C9H10BrN3/c1-5-7(10)9-8(6(2)12-5)11-4-13(9)3/h4H,1-3H3
InChIKeyRJMLVTBVKQIGKD-UHFFFAOYSA-N
XLogP2.35
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.10
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine?
The IUPAC name of 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine (CID 10847619) is 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine.
What is the SMILES notation for 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine?
The canonical SMILES for 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine is Cc1nc(C)c2ncn(C)c2c1Br.
What is the InChIKey of 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine?
The InChIKey is RJMLVTBVKQIGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN3/c1-5-7(10)9-8(6(2)12-5)11-4-13(9)3/h4H,1-3H3.
What are the key properties of 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine?
7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine has a molecular weight of 240.10 g/mol, XLogP of 2.35, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-1,4,6-trimethylimidazo[4,5-c]pyridine is sourced from PubChem (CID 10847619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).