5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane

C10H12Cl2N2 — CID 164920429

IUPAC5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane
SMILESCC.Cc1cnc2cc(Cl)cc(Cl)n12
InChIInChI=1S/C8H6Cl2N2.C2H6/c1-5-4-11-8-3-6(9)2-7(10)12(5)8;1-2/h2-4H,1H3;1-2H3
InChIKeyWXLJCDKKEYKNMZ-UHFFFAOYSA-N
MW231.13 g/mol
LogP3.98
Rot. Bonds

About 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane

5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane (PubChem CID 164920429) has the molecular formula C10H12Cl2N2 and a molecular weight of 231.13 g/mol. Its IUPAC name is 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane.

Molecular Properties

Compound Name5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane
PubChem CID164920429
Molecular FormulaC10H12Cl2N2
Molecular Weight231.13 g/mol
Exact Mass230.04
IUPAC Name5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane
SMILESCC.Cc1cnc2cc(Cl)cc(Cl)n12
InChIInChI=1S/C8H6Cl2N2.C2H6/c1-5-4-11-8-3-6(9)2-7(10)12(5)8;1-2/h2-4H,1H3;1-2H3
InChIKeyWXLJCDKKEYKNMZ-UHFFFAOYSA-N
XLogP3.98
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.13
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane?
The IUPAC name of 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane (CID 164920429) is 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane.
What is the SMILES notation for 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane?
The canonical SMILES for 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane is CC.Cc1cnc2cc(Cl)cc(Cl)n12.
What is the InChIKey of 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane?
The InChIKey is WXLJCDKKEYKNMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6Cl2N2.C2H6/c1-5-4-11-8-3-6(9)2-7(10)12(5)8;1-2/h2-4H,1H3;1-2H3.
What are the key properties of 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane?
5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane has a molecular weight of 231.13 g/mol, XLogP of 3.98, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-3-methylimidazo[1,2-a]pyridine;ethane is sourced from PubChem (CID 164920429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).