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

C9H11F2N — CID 176699020

IUPAC2-(difluoromethyl)-5-ethyl-4-methylpyridine
SMILESCCc1cnc(C(F)F)cc1C
InChIInChI=1S/C9H11F2N/c1-3-7-5-12-8(9(10)11)4-6(7)2/h4-5,9H,3H2,1-2H3
InChIKeyREVXHUDWUGXHDK-UHFFFAOYSA-N
MW171.19 g/mol
LogP2.89
Rot. Bonds2

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

2-(difluoromethyl)-5-ethyl-4-methylpyridine (PubChem CID 176699020) has the molecular formula C9H11F2N and a molecular weight of 171.19 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-ethyl-4-methylpyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-5-ethyl-4-methylpyridine
PubChem CID176699020
Molecular FormulaC9H11F2N
Molecular Weight171.19 g/mol
Exact Mass171.09
IUPAC Name2-(difluoromethyl)-5-ethyl-4-methylpyridine
SMILESCCc1cnc(C(F)F)cc1C
InChIInChI=1S/C9H11F2N/c1-3-7-5-12-8(9(10)11)4-6(7)2/h4-5,9H,3H2,1-2H3
InChIKeyREVXHUDWUGXHDK-UHFFFAOYSA-N
XLogP2.89
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.19
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(difluoromethyl)-5-ethyl-4-fluoropyridine
CID 176699553
5-ethyl-4-methyl-2-octan-3-ylpyridine
CID 174324902
2-(difluoromethyl)-4-methyl-5-(trifluoromethyl)pyridine
CID 130097653
5-ethyl-4-methyl-2-methylsulfonylpyridine
CID 89286390
ethyl 2-[4-bromo-6-(difluoromethyl)-3-pyridinyl]acetate
CID 134672940
2-[4-amino-6-(difluoromethyl)-3-pyridinyl]acetic acid
CID 118834821
2-ethenyl-5-ethyl-4-methylpyridine
CID 45079614
4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane
CID 176699217
4-(difluoromethyl)-1-ethyl-2-methylbenzene
CID 89190033
ethyl 6-(difluoromethyl)-4-fluoropyridine-3-carboxylate
CID 133091151
ethyl 4-chloro-6-(difluoromethyl)pyridine-3-carboxylate
CID 133088345
ethyl 6-(difluoromethyl)-4-methoxypyridine-3-carboxylate
CID 134682660

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-ethyl-4-methylpyridine?
The IUPAC name of 2-(difluoromethyl)-5-ethyl-4-methylpyridine (CID 176699020) is 2-(difluoromethyl)-5-ethyl-4-methylpyridine.
What is the SMILES notation for 2-(difluoromethyl)-5-ethyl-4-methylpyridine?
The canonical SMILES for 2-(difluoromethyl)-5-ethyl-4-methylpyridine is CCc1cnc(C(F)F)cc1C.
What is the InChIKey of 2-(difluoromethyl)-5-ethyl-4-methylpyridine?
The InChIKey is REVXHUDWUGXHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2N/c1-3-7-5-12-8(9(10)11)4-6(7)2/h4-5,9H,3H2,1-2H3.
What are the key properties of 2-(difluoromethyl)-5-ethyl-4-methylpyridine?
2-(difluoromethyl)-5-ethyl-4-methylpyridine has a molecular weight of 171.19 g/mol, XLogP of 2.89, 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-methylpyridine is sourced from PubChem (CID 176699020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).