5-cyclopropyloxy-2,3-difluoropyridine

C8H7F2NO — CID 130057394

IUPAC5-cyclopropyloxy-2,3-difluoropyridine
SMILESFc1cc(OC2CC2)cnc1F
InChIInChI=1S/C8H7F2NO/c9-7-3-6(4-11-8(7)10)12-5-1-2-5/h3-5H,1-2H2
InChIKeyDSWGOUORQVUFIW-UHFFFAOYSA-N
MW171.15 g/mol
LogP1.90
Rot. Bonds2

About 5-cyclopropyloxy-2,3-difluoropyridine

5-cyclopropyloxy-2,3-difluoropyridine (PubChem CID 130057394) has the molecular formula C8H7F2NO and a molecular weight of 171.15 g/mol. Its IUPAC name is 5-cyclopropyloxy-2,3-difluoropyridine.

Molecular Properties

Compound Name5-cyclopropyloxy-2,3-difluoropyridine
PubChem CID130057394
Molecular FormulaC8H7F2NO
Molecular Weight171.15 g/mol
Exact Mass171.05
IUPAC Name5-cyclopropyloxy-2,3-difluoropyridine
SMILESFc1cc(OC2CC2)cnc1F
InChIInChI=1S/C8H7F2NO/c9-7-3-6(4-11-8(7)10)12-5-1-2-5/h3-5H,1-2H2
InChIKeyDSWGOUORQVUFIW-UHFFFAOYSA-N
XLogP1.90
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.15
LogP ≤ 51.90
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-cyclopropyloxy-2,3-difluoropyridine?
The IUPAC name of 5-cyclopropyloxy-2,3-difluoropyridine (CID 130057394) is 5-cyclopropyloxy-2,3-difluoropyridine.
What is the SMILES notation for 5-cyclopropyloxy-2,3-difluoropyridine?
The canonical SMILES for 5-cyclopropyloxy-2,3-difluoropyridine is Fc1cc(OC2CC2)cnc1F.
What is the InChIKey of 5-cyclopropyloxy-2,3-difluoropyridine?
The InChIKey is DSWGOUORQVUFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F2NO/c9-7-3-6(4-11-8(7)10)12-5-1-2-5/h3-5H,1-2H2.
What are the key properties of 5-cyclopropyloxy-2,3-difluoropyridine?
5-cyclopropyloxy-2,3-difluoropyridine has a molecular weight of 171.15 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyloxy-2,3-difluoropyridine is sourced from PubChem (CID 130057394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).