5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine

C15H14FNO2 — CID 113296520

IUPAC5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine
SMILESFc1ccc(OCCc2ccc3c(c2)CCO3)cn1
InChIInChI=1S/C15H14FNO2/c16-15-4-2-13(10-17-15)18-7-5-11-1-3-14-12(9-11)6-8-19-14/h1-4,9-10H,5-8H2
InChIKeyZDZYWIQPTWYDMT-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.78
Rot. Bonds4

About 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine

5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine (PubChem CID 113296520) has the molecular formula C15H14FNO2 and a molecular weight of 259.28 g/mol. Its IUPAC name is 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine.

Molecular Properties

Compound Name5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine
PubChem CID113296520
Molecular FormulaC15H14FNO2
Molecular Weight259.28 g/mol
Exact Mass259.10
IUPAC Name5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine
SMILESFc1ccc(OCCc2ccc3c(c2)CCO3)cn1
InChIInChI=1S/C15H14FNO2/c16-15-4-2-13(10-17-15)18-7-5-11-1-3-14-12(9-11)6-8-19-14/h1-4,9-10H,5-8H2
InChIKeyZDZYWIQPTWYDMT-UHFFFAOYSA-N
XLogP2.78
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]acetonitrile
CID 65446556
2-chloro-4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]aniline
CID 65431769
5-[2-(4-bromo-3,5-dimethylphenoxy)ethyl]-2,3-dihydro-1-benzofuran
CID 107723704
2-chloro-4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]benzonitrile
CID 102674746
4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-3-fluorobenzaldehyde
CID 102670873
5-[2-(5-bromo-2,3-difluorophenoxy)ethyl]-2,3-dihydro-1-benzofuran
CID 107098626
1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-[3-(4-fluorophenoxy)propyl]urea
CID 86952371
[2-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-3-fluorophenyl]methanamine
CID 115952093
5-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1-benzofuran
CID 65441677
3-bromo-2-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-5-fluoroaniline
CID 65430275
1-[3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]phenyl]ethanol
CID 65445625
5-[2-[4-bromo-2-(bromomethyl)phenoxy]ethyl]-2,3-dihydro-1-benzofuran
CID 65445258

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine?
The IUPAC name of 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine (CID 113296520) is 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine.
What is the SMILES notation for 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine?
The canonical SMILES for 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine is Fc1ccc(OCCc2ccc3c(c2)CCO3)cn1.
What is the InChIKey of 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine?
The InChIKey is ZDZYWIQPTWYDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO2/c16-15-4-2-13(10-17-15)18-7-5-11-1-3-14-12(9-11)6-8-19-14/h1-4,9-10H,5-8H2.
What are the key properties of 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine?
5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine has a molecular weight of 259.28 g/mol, XLogP of 2.78, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2,3-dihydro-1-benzofuran-5-yl)ethoxy]-2-fluoropyridine is sourced from PubChem (CID 113296520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).