2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine

C15H15F2NO2 — CID 19436542

IUPAC2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine
SMILESCCCOc1ccc(-c2ccc(OC(F)F)cc2)nc1
InChIInChI=1S/C15H15F2NO2/c1-2-9-19-13-7-8-14(18-10-13)11-3-5-12(6-4-11)20-15(16)17/h3-8,10,15H,2,9H2,1H3
InChIKeyHZADFIWVFXQQSN-UHFFFAOYSA-N
MW279.29 g/mol
LogP4.14
Rot. Bonds6

About 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine

2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine (PubChem CID 19436542) has the molecular formula C15H15F2NO2 and a molecular weight of 279.29 g/mol. Its IUPAC name is 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine.

Molecular Properties

Compound Name2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine
PubChem CID19436542
Molecular FormulaC15H15F2NO2
Molecular Weight279.29 g/mol
Exact Mass279.11
IUPAC Name2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine
SMILESCCCOc1ccc(-c2ccc(OC(F)F)cc2)nc1
InChIInChI=1S/C15H15F2NO2/c1-2-9-19-13-7-8-14(18-10-13)11-3-5-12(6-4-11)20-15(16)17/h3-8,10,15H,2,9H2,1H3
InChIKeyHZADFIWVFXQQSN-UHFFFAOYSA-N
XLogP4.14
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine 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 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine?
The IUPAC name of 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine (CID 19436542) is 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine.
What is the SMILES notation for 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine?
The canonical SMILES for 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine is CCCOc1ccc(-c2ccc(OC(F)F)cc2)nc1.
What is the InChIKey of 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine?
The InChIKey is HZADFIWVFXQQSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO2/c1-2-9-19-13-7-8-14(18-10-13)11-3-5-12(6-4-11)20-15(16)17/h3-8,10,15H,2,9H2,1H3.
What are the key properties of 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine?
2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine has a molecular weight of 279.29 g/mol, XLogP of 4.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethoxy)phenyl]-5-propoxypyridine is sourced from PubChem (CID 19436542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).