2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine

C18H20FN — CID 170582447

IUPAC2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine
SMILESCCc1cc(C2(C)CCC2)cc(-c2ccc(F)cc2)n1
InChIInChI=1S/C18H20FN/c1-3-16-11-14(18(2)9-4-10-18)12-17(20-16)13-5-7-15(19)8-6-13/h5-8,11-12H,3-4,9-10H2,1-2H3
InChIKeyDAFGDSZDEHLEGM-UHFFFAOYSA-N
MW269.36 g/mol
LogP4.89
Rot. Bonds3

About 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine

2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine (PubChem CID 170582447) has the molecular formula C18H20FN and a molecular weight of 269.36 g/mol. Its IUPAC name is 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine.

Molecular Properties

Compound Name2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine
PubChem CID170582447
Molecular FormulaC18H20FN
Molecular Weight269.36 g/mol
Exact Mass269.16
IUPAC Name2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine
SMILESCCc1cc(C2(C)CCC2)cc(-c2ccc(F)cc2)n1
InChIInChI=1S/C18H20FN/c1-3-16-11-14(18(2)9-4-10-18)12-17(20-16)13-5-7-15(19)8-6-13/h5-8,11-12H,3-4,9-10H2,1-2H3
InChIKeyDAFGDSZDEHLEGM-UHFFFAOYSA-N
XLogP4.89
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.36
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine?
The IUPAC name of 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine (CID 170582447) is 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine.
What is the SMILES notation for 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine?
The canonical SMILES for 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine is CCc1cc(C2(C)CCC2)cc(-c2ccc(F)cc2)n1.
What is the InChIKey of 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine?
The InChIKey is DAFGDSZDEHLEGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN/c1-3-16-11-14(18(2)9-4-10-18)12-17(20-16)13-5-7-15(19)8-6-13/h5-8,11-12H,3-4,9-10H2,1-2H3.
What are the key properties of 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine?
2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine has a molecular weight of 269.36 g/mol, XLogP of 4.89, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(4-fluorophenyl)-4-(1-methylcyclobutyl)pyridine is sourced from PubChem (CID 170582447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).