4-chloro-2-ethylfuro[3,2-c]pyridine

C9H8ClNO — CID 71756241

IUPAC4-chloro-2-ethylfuro[3,2-c]pyridine
SMILESCCc1cc2c(Cl)nccc2o1
InChIInChI=1S/C9H8ClNO/c1-2-6-5-7-8(12-6)3-4-11-9(7)10/h3-5H,2H2,1H3
InChIKeyJYVFPUCOBMPXEH-UHFFFAOYSA-N
MW181.62 g/mol
LogP3.04
Rot. Bonds1

About 4-chloro-2-ethylfuro[3,2-c]pyridine

4-chloro-2-ethylfuro[3,2-c]pyridine (PubChem CID 71756241) has the molecular formula C9H8ClNO and a molecular weight of 181.62 g/mol. Its IUPAC name is 4-chloro-2-ethylfuro[3,2-c]pyridine.

Molecular Properties

Compound Name4-chloro-2-ethylfuro[3,2-c]pyridine
PubChem CID71756241
Molecular FormulaC9H8ClNO
Molecular Weight181.62 g/mol
Exact Mass181.03
IUPAC Name4-chloro-2-ethylfuro[3,2-c]pyridine
SMILESCCc1cc2c(Cl)nccc2o1
InChIInChI=1S/C9H8ClNO/c1-2-6-5-7-8(12-6)3-4-11-9(7)10/h3-5H,2H2,1H3
InChIKeyJYVFPUCOBMPXEH-UHFFFAOYSA-N
XLogP3.04
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.62
LogP ≤ 53.04
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 4-chloro-2-ethylfuro[3,2-c]pyridine?
The IUPAC name of 4-chloro-2-ethylfuro[3,2-c]pyridine (CID 71756241) is 4-chloro-2-ethylfuro[3,2-c]pyridine.
What is the SMILES notation for 4-chloro-2-ethylfuro[3,2-c]pyridine?
The canonical SMILES for 4-chloro-2-ethylfuro[3,2-c]pyridine is CCc1cc2c(Cl)nccc2o1.
What is the InChIKey of 4-chloro-2-ethylfuro[3,2-c]pyridine?
The InChIKey is JYVFPUCOBMPXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClNO/c1-2-6-5-7-8(12-6)3-4-11-9(7)10/h3-5H,2H2,1H3.
What are the key properties of 4-chloro-2-ethylfuro[3,2-c]pyridine?
4-chloro-2-ethylfuro[3,2-c]pyridine has a molecular weight of 181.62 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethylfuro[3,2-c]pyridine is sourced from PubChem (CID 71756241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).