3,5-dichloro-4-ethoxy-2,6-dimethylpyridine

C9H11Cl2NO — CID 605771

IUPAC3,5-dichloro-4-ethoxy-2,6-dimethylpyridine
SMILESCCOc1c(Cl)c(C)nc(C)c1Cl
InChIInChI=1S/C9H11Cl2NO/c1-4-13-9-7(10)5(2)12-6(3)8(9)11/h4H2,1-3H3
InChIKeyYCAKOFRZPSUGKF-UHFFFAOYSA-N
MW220.10 g/mol
LogP3.40
Rot. Bonds2

About 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine

3,5-dichloro-4-ethoxy-2,6-dimethylpyridine (PubChem CID 605771) has the molecular formula C9H11Cl2NO and a molecular weight of 220.10 g/mol. Its IUPAC name is 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine.

Molecular Properties

Compound Name3,5-dichloro-4-ethoxy-2,6-dimethylpyridine
PubChem CID605771
Molecular FormulaC9H11Cl2NO
Molecular Weight220.10 g/mol
Exact Mass219.02
IUPAC Name3,5-dichloro-4-ethoxy-2,6-dimethylpyridine
SMILESCCOc1c(Cl)c(C)nc(C)c1Cl
InChIInChI=1S/C9H11Cl2NO/c1-4-13-9-7(10)5(2)12-6(3)8(9)11/h4H2,1-3H3
InChIKeyYCAKOFRZPSUGKF-UHFFFAOYSA-N
XLogP3.40
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.10
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine?
The IUPAC name of 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine (CID 605771) is 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine.
What is the SMILES notation for 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine?
The canonical SMILES for 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine is CCOc1c(Cl)c(C)nc(C)c1Cl.
What is the InChIKey of 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine?
The InChIKey is YCAKOFRZPSUGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2NO/c1-4-13-9-7(10)5(2)12-6(3)8(9)11/h4H2,1-3H3.
What are the key properties of 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine?
3,5-dichloro-4-ethoxy-2,6-dimethylpyridine has a molecular weight of 220.10 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-ethoxy-2,6-dimethylpyridine is sourced from PubChem (CID 605771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).