5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine

C15H23NO — CID 159725821

IUPAC5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine
SMILESCC(C)(C)c1cc2c(nc1C(C)(C)C)CCO2
InChIInChI=1S/C15H23NO/c1-14(2,3)10-9-12-11(7-8-17-12)16-13(10)15(4,5)6/h9H,7-8H2,1-6H3
InChIKeyQGWAVOKJXNOYGY-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.61
Rot. Bonds

About 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine

5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine (PubChem CID 159725821) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine.

Molecular Properties

Compound Name5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine
PubChem CID159725821
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine
SMILESCC(C)(C)c1cc2c(nc1C(C)(C)C)CCO2
InChIInChI=1S/C15H23NO/c1-14(2,3)10-9-12-11(7-8-17-12)16-13(10)15(4,5)6/h9H,7-8H2,1-6H3
InChIKeyQGWAVOKJXNOYGY-UHFFFAOYSA-N
XLogP3.61
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine?
The IUPAC name of 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine (CID 159725821) is 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine.
What is the SMILES notation for 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine?
The canonical SMILES for 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine is CC(C)(C)c1cc2c(nc1C(C)(C)C)CCO2.
What is the InChIKey of 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine?
The InChIKey is QGWAVOKJXNOYGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-14(2,3)10-9-12-11(7-8-17-12)16-13(10)15(4,5)6/h9H,7-8H2,1-6H3.
What are the key properties of 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine?
5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine has a molecular weight of 233.35 g/mol, XLogP of 3.61, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-ditert-butyl-2,3-dihydrofuro[3,2-b]pyridine is sourced from PubChem (CID 159725821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).