6-ethyl-3,5-difluoro-3-methyl-2H-pyridine

C8H11F2N — CID 165398323

IUPAC6-ethyl-3,5-difluoro-3-methyl-2H-pyridine
SMILESCCC1=NCC(C)(F)C=C1F
InChIInChI=1S/C8H11F2N/c1-3-7-6(9)4-8(2,10)5-11-7/h4H,3,5H2,1-2H3
InChIKeyRUAAYDUKXBXPMF-UHFFFAOYSA-N
MW159.18 g/mol
LogP2.43
Rot. Bonds1

About 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine

6-ethyl-3,5-difluoro-3-methyl-2H-pyridine (PubChem CID 165398323) has the molecular formula C8H11F2N and a molecular weight of 159.18 g/mol. Its IUPAC name is 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine.

Molecular Properties

Compound Name6-ethyl-3,5-difluoro-3-methyl-2H-pyridine
PubChem CID165398323
Molecular FormulaC8H11F2N
Molecular Weight159.18 g/mol
Exact Mass159.09
IUPAC Name6-ethyl-3,5-difluoro-3-methyl-2H-pyridine
SMILESCCC1=NCC(C)(F)C=C1F
InChIInChI=1S/C8H11F2N/c1-3-7-6(9)4-8(2,10)5-11-7/h4H,3,5H2,1-2H3
InChIKeyRUAAYDUKXBXPMF-UHFFFAOYSA-N
XLogP2.43
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.18
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-5-fluoro-2,6-dimethyl-2,3-dihydropyridine
CID 67991606
(2S)-6-(2-fluoroethyl)-2-methyl-2,3-dihydropyridine
CID 67991646
6-Ethyl-5-fluoro-3-methyl-2,3-dihydropyridine
CID 91228283
6-(Difluoromethyl)-3-ethyl-5-methyl-2,3-dihydropyridine
CID 91353665
(E)-N-methyl-3-(trifluoromethyl)hex-3-en-2-imine
CID 123199800
(Z)-2-fluoro-N,4-dimethylhex-4-en-3-imine
CID 123257135
(E)-N-(2-fluoro-2-methylpropyl)-3-methylpent-3-en-2-imine
CID 123979160
(E)-3-(1,1-difluoroethyl)-N-ethylpent-3-en-2-imine
CID 123999875
1,1,1-trifluoro-4-methyl-N-propylpent-3-en-2-imine
CID 138509578
6-(Difluoromethyl)-4-fluoro-2,5-dimethyl-2,3-dihydropyridine
CID 139526386
(6E)-3,5-difluoro-N-methyl-6-(2-methylprop-2-enylidene)cyclohexa-2,4-dien-1-imine
CID 142275946
(E)-4-fluoro-N,2-dimethylhept-4-en-3-imine
CID 142523799

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine?
The IUPAC name of 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine (CID 165398323) is 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine.
What is the SMILES notation for 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine?
The canonical SMILES for 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine is CCC1=NCC(C)(F)C=C1F.
What is the InChIKey of 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine?
The InChIKey is RUAAYDUKXBXPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N/c1-3-7-6(9)4-8(2,10)5-11-7/h4H,3,5H2,1-2H3.
What are the key properties of 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine?
6-ethyl-3,5-difluoro-3-methyl-2H-pyridine has a molecular weight of 159.18 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3,5-difluoro-3-methyl-2H-pyridine is sourced from PubChem (CID 165398323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).