5-(difluoromethoxy)-2,3-dimethylpyridine

C8H9F2NO — CID 130882921

IUPAC5-(difluoromethoxy)-2,3-dimethylpyridine
SMILESCc1cc(OC(F)F)cnc1C
InChIInChI=1S/C8H9F2NO/c1-5-3-7(12-8(9)10)4-11-6(5)2/h3-4,8H,1-2H3
InChIKeyQUTSDMUSPAGKLF-UHFFFAOYSA-N
MW173.16 g/mol
LogP2.30
Rot. Bonds2

About 5-(difluoromethoxy)-2,3-dimethylpyridine

5-(difluoromethoxy)-2,3-dimethylpyridine (PubChem CID 130882921) has the molecular formula C8H9F2NO and a molecular weight of 173.16 g/mol. Its IUPAC name is 5-(difluoromethoxy)-2,3-dimethylpyridine.

Molecular Properties

Compound Name5-(difluoromethoxy)-2,3-dimethylpyridine
PubChem CID130882921
Molecular FormulaC8H9F2NO
Molecular Weight173.16 g/mol
Exact Mass173.07
IUPAC Name5-(difluoromethoxy)-2,3-dimethylpyridine
SMILESCc1cc(OC(F)F)cnc1C
InChIInChI=1S/C8H9F2NO/c1-5-3-7(12-8(9)10)4-11-6(5)2/h3-4,8H,1-2H3
InChIKeyQUTSDMUSPAGKLF-UHFFFAOYSA-N
XLogP2.30
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.16
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethoxy)-2,3-dimethylpyridine?
The IUPAC name of 5-(difluoromethoxy)-2,3-dimethylpyridine (CID 130882921) is 5-(difluoromethoxy)-2,3-dimethylpyridine.
What is the SMILES notation for 5-(difluoromethoxy)-2,3-dimethylpyridine?
The canonical SMILES for 5-(difluoromethoxy)-2,3-dimethylpyridine is Cc1cc(OC(F)F)cnc1C.
What is the InChIKey of 5-(difluoromethoxy)-2,3-dimethylpyridine?
The InChIKey is QUTSDMUSPAGKLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2NO/c1-5-3-7(12-8(9)10)4-11-6(5)2/h3-4,8H,1-2H3.
What are the key properties of 5-(difluoromethoxy)-2,3-dimethylpyridine?
5-(difluoromethoxy)-2,3-dimethylpyridine has a molecular weight of 173.16 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)-2,3-dimethylpyridine is sourced from PubChem (CID 130882921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).