1-propylimidazo[4,5-b]pyridine

C9H11N3 — CID 11768867

IUPAC1-propylimidazo[4,5-b]pyridine
SMILESCCCn1cnc2ncccc21
InChIInChI=1S/C9H11N3/c1-2-6-12-7-11-9-8(12)4-3-5-10-9/h3-5,7H,2,6H2,1H3
InChIKeyRKHFEMRZAMDVAS-UHFFFAOYSA-N
MW161.21 g/mol
LogP1.84
Rot. Bonds2

About 1-propylimidazo[4,5-b]pyridine

1-propylimidazo[4,5-b]pyridine (PubChem CID 11768867) has the molecular formula C9H11N3 and a molecular weight of 161.21 g/mol. Its IUPAC name is 1-propylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name1-propylimidazo[4,5-b]pyridine
PubChem CID11768867
Molecular FormulaC9H11N3
Molecular Weight161.21 g/mol
Exact Mass161.10
IUPAC Name1-propylimidazo[4,5-b]pyridine
SMILESCCCn1cnc2ncccc21
InChIInChI=1S/C9H11N3/c1-2-6-12-7-11-9-8(12)4-3-5-10-9/h3-5,7H,2,6H2,1H3
InChIKeyRKHFEMRZAMDVAS-UHFFFAOYSA-N
XLogP1.84
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.21
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-propylimidazo[4,5-b]pyridine?
The IUPAC name of 1-propylimidazo[4,5-b]pyridine (CID 11768867) is 1-propylimidazo[4,5-b]pyridine.
What is the SMILES notation for 1-propylimidazo[4,5-b]pyridine?
The canonical SMILES for 1-propylimidazo[4,5-b]pyridine is CCCn1cnc2ncccc21.
What is the InChIKey of 1-propylimidazo[4,5-b]pyridine?
The InChIKey is RKHFEMRZAMDVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3/c1-2-6-12-7-11-9-8(12)4-3-5-10-9/h3-5,7H,2,6H2,1H3.
What are the key properties of 1-propylimidazo[4,5-b]pyridine?
1-propylimidazo[4,5-b]pyridine has a molecular weight of 161.21 g/mol, XLogP of 1.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propylimidazo[4,5-b]pyridine is sourced from PubChem (CID 11768867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).