1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine

C15H17F2N — CID 151445093

IUPAC1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine
SMILESCCC1=CN(c2ccc(F)cc2F)C(CC)C=C1
InChIInChI=1S/C15H17F2N/c1-3-11-5-7-13(4-2)18(10-11)15-8-6-12(16)9-14(15)17/h5-10,13H,3-4H2,1-2H3
InChIKeyKKVFGTFUKHCGGY-UHFFFAOYSA-N
MW249.30 g/mol
LogP4.41
Rot. Bonds3

About 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine

1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine (PubChem CID 151445093) has the molecular formula C15H17F2N and a molecular weight of 249.30 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine
PubChem CID151445093
Molecular FormulaC15H17F2N
Molecular Weight249.30 g/mol
Exact Mass249.13
IUPAC Name1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine
SMILESCCC1=CN(c2ccc(F)cc2F)C(CC)C=C1
InChIInChI=1S/C15H17F2N/c1-3-11-5-7-13(4-2)18(10-11)15-8-6-12(16)9-14(15)17/h5-10,13H,3-4H2,1-2H3
InChIKeyKKVFGTFUKHCGGY-UHFFFAOYSA-N
XLogP4.41
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-(2,4-difluorophenyl)-3-propyl-1,4-diazepane
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6-[(2,4-difluorophenyl)methoxymethyl]-3-propan-2-yl-1,8a-dihydro-[1,2,4]triazolo[4,3-a]pyridine
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1-(2,4-difluorophenyl)-N-ethyl-5-methylpiperidin-3-amine
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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine?
The IUPAC name of 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine (CID 151445093) is 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine?
The canonical SMILES for 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine is CCC1=CN(c2ccc(F)cc2F)C(CC)C=C1.
What is the InChIKey of 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine?
The InChIKey is KKVFGTFUKHCGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F2N/c1-3-11-5-7-13(4-2)18(10-11)15-8-6-12(16)9-14(15)17/h5-10,13H,3-4H2,1-2H3.
What are the key properties of 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine?
1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine has a molecular weight of 249.30 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2,5-diethyl-2H-pyridine is sourced from PubChem (CID 151445093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).