2-ethyl-5-fluoro-4-propan-2-ylpyridine

C10H14FN — CID 137409509

IUPAC2-ethyl-5-fluoro-4-propan-2-ylpyridine
SMILESCCc1cc(C(C)C)c(F)cn1
InChIInChI=1S/C10H14FN/c1-4-8-5-9(7(2)3)10(11)6-12-8/h5-7H,4H2,1-3H3
InChIKeyGYBXVWOWSRQIPO-UHFFFAOYSA-N
MW167.23 g/mol
LogP2.91
Rot. Bonds2

About 2-ethyl-5-fluoro-4-propan-2-ylpyridine

2-ethyl-5-fluoro-4-propan-2-ylpyridine (PubChem CID 137409509) has the molecular formula C10H14FN and a molecular weight of 167.23 g/mol. Its IUPAC name is 2-ethyl-5-fluoro-4-propan-2-ylpyridine.

Molecular Properties

Compound Name2-ethyl-5-fluoro-4-propan-2-ylpyridine
PubChem CID137409509
Molecular FormulaC10H14FN
Molecular Weight167.23 g/mol
Exact Mass167.11
IUPAC Name2-ethyl-5-fluoro-4-propan-2-ylpyridine
SMILESCCc1cc(C(C)C)c(F)cn1
InChIInChI=1S/C10H14FN/c1-4-8-5-9(7(2)3)10(11)6-12-8/h5-7H,4H2,1-3H3
InChIKeyGYBXVWOWSRQIPO-UHFFFAOYSA-N
XLogP2.91
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-fluoro-4-propan-2-ylpyridine?
The IUPAC name of 2-ethyl-5-fluoro-4-propan-2-ylpyridine (CID 137409509) is 2-ethyl-5-fluoro-4-propan-2-ylpyridine.
What is the SMILES notation for 2-ethyl-5-fluoro-4-propan-2-ylpyridine?
The canonical SMILES for 2-ethyl-5-fluoro-4-propan-2-ylpyridine is CCc1cc(C(C)C)c(F)cn1.
What is the InChIKey of 2-ethyl-5-fluoro-4-propan-2-ylpyridine?
The InChIKey is GYBXVWOWSRQIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN/c1-4-8-5-9(7(2)3)10(11)6-12-8/h5-7H,4H2,1-3H3.
What are the key properties of 2-ethyl-5-fluoro-4-propan-2-ylpyridine?
2-ethyl-5-fluoro-4-propan-2-ylpyridine has a molecular weight of 167.23 g/mol, XLogP of 2.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-fluoro-4-propan-2-ylpyridine is sourced from PubChem (CID 137409509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).