4-ethoxy-2-ethylpyridine

C9H13NO — CID 59520086

IUPAC4-ethoxy-2-ethylpyridine
SMILESCCOc1ccnc(CC)c1
InChIInChI=1S/C9H13NO/c1-3-8-7-9(11-4-2)5-6-10-8/h5-7H,3-4H2,1-2H3
InChIKeyNWYRZTGYXMGRBE-UHFFFAOYSA-N
MW151.21 g/mol
LogP2.04
Rot. Bonds3

About 4-ethoxy-2-ethylpyridine

4-ethoxy-2-ethylpyridine (PubChem CID 59520086) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 4-ethoxy-2-ethylpyridine.

Molecular Properties

Compound Name4-ethoxy-2-ethylpyridine
PubChem CID59520086
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name4-ethoxy-2-ethylpyridine
SMILESCCOc1ccnc(CC)c1
InChIInChI=1S/C9H13NO/c1-3-8-7-9(11-4-2)5-6-10-8/h5-7H,3-4H2,1-2H3
InChIKeyNWYRZTGYXMGRBE-UHFFFAOYSA-N
XLogP2.04
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-ethylpyridine?
The IUPAC name of 4-ethoxy-2-ethylpyridine (CID 59520086) is 4-ethoxy-2-ethylpyridine.
What is the SMILES notation for 4-ethoxy-2-ethylpyridine?
The canonical SMILES for 4-ethoxy-2-ethylpyridine is CCOc1ccnc(CC)c1.
What is the InChIKey of 4-ethoxy-2-ethylpyridine?
The InChIKey is NWYRZTGYXMGRBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-8-7-9(11-4-2)5-6-10-8/h5-7H,3-4H2,1-2H3.
What are the key properties of 4-ethoxy-2-ethylpyridine?
4-ethoxy-2-ethylpyridine has a molecular weight of 151.21 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-ethylpyridine is sourced from PubChem (CID 59520086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).