7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine

C9H10ClN3 — CID 135253364

IUPAC7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine
SMILESCCc1cnc2c(ncn2C)c1Cl
InChIInChI=1S/C9H10ClN3/c1-3-6-4-11-9-8(7(6)10)12-5-13(9)2/h4-5H,3H2,1-2H3
InChIKeyNOENHVCARFLMOL-UHFFFAOYSA-N
MW195.65 g/mol
LogP2.18
Rot. Bonds1

About 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine

7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine (PubChem CID 135253364) has the molecular formula C9H10ClN3 and a molecular weight of 195.65 g/mol. Its IUPAC name is 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine
PubChem CID135253364
Molecular FormulaC9H10ClN3
Molecular Weight195.65 g/mol
Exact Mass195.06
IUPAC Name7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine
SMILESCCc1cnc2c(ncn2C)c1Cl
InChIInChI=1S/C9H10ClN3/c1-3-6-4-11-9-8(7(6)10)12-5-13(9)2/h4-5H,3H2,1-2H3
InChIKeyNOENHVCARFLMOL-UHFFFAOYSA-N
XLogP2.18
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine?
The IUPAC name of 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine (CID 135253364) is 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine.
What is the SMILES notation for 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine?
The canonical SMILES for 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine is CCc1cnc2c(ncn2C)c1Cl.
What is the InChIKey of 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine?
The InChIKey is NOENHVCARFLMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3/c1-3-6-4-11-9-8(7(6)10)12-5-13(9)2/h4-5H,3H2,1-2H3.
What are the key properties of 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine?
7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine has a molecular weight of 195.65 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6-ethyl-3-methylimidazo[4,5-b]pyridine is sourced from PubChem (CID 135253364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).