2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine

C10H11ClN2O — CID 19367133

IUPAC2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine
SMILESCCOc1ccc2nc(CCl)cn2c1
InChIInChI=1S/C10H11ClN2O/c1-2-14-9-3-4-10-12-8(5-11)6-13(10)7-9/h3-4,6-7H,2,5H2,1H3
InChIKeyGQPRIEAFVBCYJC-UHFFFAOYSA-N
MW210.66 g/mol
LogP2.47
Rot. Bonds3

About 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine

2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine (PubChem CID 19367133) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine
PubChem CID19367133
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC Name2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine
SMILESCCOc1ccc2nc(CCl)cn2c1
InChIInChI=1S/C10H11ClN2O/c1-2-14-9-3-4-10-12-8(5-11)6-13(10)7-9/h3-4,6-7H,2,5H2,1H3
InChIKeyGQPRIEAFVBCYJC-UHFFFAOYSA-N
XLogP2.47
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine?
The IUPAC name of 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine (CID 19367133) is 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine is CCOc1ccc2nc(CCl)cn2c1.
What is the InChIKey of 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine?
The InChIKey is GQPRIEAFVBCYJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c1-2-14-9-3-4-10-12-8(5-11)6-13(10)7-9/h3-4,6-7H,2,5H2,1H3.
What are the key properties of 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine?
2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine has a molecular weight of 210.66 g/mol, XLogP of 2.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)-6-ethoxyimidazo[1,2-a]pyridine is sourced from PubChem (CID 19367133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).