2-(difluoromethyl)-5-ethyl-4-fluoropyridine

C8H8F3N — CID 176699553

IUPAC2-(difluoromethyl)-5-ethyl-4-fluoropyridine
SMILESCCc1cnc(C(F)F)cc1F
InChIInChI=1S/C8H8F3N/c1-2-5-4-12-7(8(10)11)3-6(5)9/h3-4,8H,2H2,1H3
InChIKeyRSCQUBSTBXLUSN-UHFFFAOYSA-N
MW175.15 g/mol
LogP2.72
Rot. Bonds2

About 2-(difluoromethyl)-5-ethyl-4-fluoropyridine

2-(difluoromethyl)-5-ethyl-4-fluoropyridine (PubChem CID 176699553) has the molecular formula C8H8F3N and a molecular weight of 175.15 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-ethyl-4-fluoropyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-5-ethyl-4-fluoropyridine
PubChem CID176699553
Molecular FormulaC8H8F3N
Molecular Weight175.15 g/mol
Exact Mass175.06
IUPAC Name2-(difluoromethyl)-5-ethyl-4-fluoropyridine
SMILESCCc1cnc(C(F)F)cc1F
InChIInChI=1S/C8H8F3N/c1-2-5-4-12-7(8(10)11)3-6(5)9/h3-4,8H,2H2,1H3
InChIKeyRSCQUBSTBXLUSN-UHFFFAOYSA-N
XLogP2.72
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.15
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(difluoromethyl)-5-ethyl-4-methylpyridine
CID 176699020
5-ethyl-4-fluoropyridin-2-amine
CID 164886322
ethyl 6-(difluoromethyl)-4-fluoropyridine-3-carboxylate
CID 133091151
2-[4-amino-6-(difluoromethyl)-3-pyridinyl]acetic acid
CID 118834821
6-(difluoromethyl)-4-fluoropyridine-3-carbonitrile
CID 130095794
ethyl 2-[4-bromo-6-(difluoromethyl)-3-pyridinyl]acetate
CID 134672940
2-(difluoromethyl)-5-fluoropyridine-4-carboxylic acid
CID 118809173
2-[5-chloro-2-(difluoromethyl)-4-pyridinyl]acetic acid
CID 130095692
4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane
CID 176699217
2-[6-(difluoromethyl)-4-iodo-3-pyridinyl]acetonitrile
CID 118848604
methyl 2-[5-chloro-2-(difluoromethyl)-4-pyridinyl]acetate
CID 133088543
4,5-difluoro-2-propan-2-ylpyridine
CID 170611007

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-ethyl-4-fluoropyridine?
The IUPAC name of 2-(difluoromethyl)-5-ethyl-4-fluoropyridine (CID 176699553) is 2-(difluoromethyl)-5-ethyl-4-fluoropyridine.
What is the SMILES notation for 2-(difluoromethyl)-5-ethyl-4-fluoropyridine?
The canonical SMILES for 2-(difluoromethyl)-5-ethyl-4-fluoropyridine is CCc1cnc(C(F)F)cc1F.
What is the InChIKey of 2-(difluoromethyl)-5-ethyl-4-fluoropyridine?
The InChIKey is RSCQUBSTBXLUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N/c1-2-5-4-12-7(8(10)11)3-6(5)9/h3-4,8H,2H2,1H3.
What are the key properties of 2-(difluoromethyl)-5-ethyl-4-fluoropyridine?
2-(difluoromethyl)-5-ethyl-4-fluoropyridine has a molecular weight of 175.15 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-ethyl-4-fluoropyridine is sourced from PubChem (CID 176699553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).