4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine

C10H14ClNO2 — CID 19032537

IUPAC4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine
SMILESCCOCc1nccc(Cl)c1OCC
InChIInChI=1S/C10H14ClNO2/c1-3-13-7-9-10(14-4-2)8(11)5-6-12-9/h5-6H,3-4,7H2,1-2H3
InChIKeyANDTUSZCYWXNLQ-UHFFFAOYSA-N
MW215.68 g/mol
LogP2.67
Rot. Bonds5

About 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine

4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine (PubChem CID 19032537) has the molecular formula C10H14ClNO2 and a molecular weight of 215.68 g/mol. Its IUPAC name is 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine.

Molecular Properties

Compound Name4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine
PubChem CID19032537
Molecular FormulaC10H14ClNO2
Molecular Weight215.68 g/mol
Exact Mass215.07
IUPAC Name4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine
SMILESCCOCc1nccc(Cl)c1OCC
InChIInChI=1S/C10H14ClNO2/c1-3-13-7-9-10(14-4-2)8(11)5-6-12-9/h5-6H,3-4,7H2,1-2H3
InChIKeyANDTUSZCYWXNLQ-UHFFFAOYSA-N
XLogP2.67
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.68
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine?
The IUPAC name of 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine (CID 19032537) is 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine.
What is the SMILES notation for 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine?
The canonical SMILES for 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine is CCOCc1nccc(Cl)c1OCC.
What is the InChIKey of 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine?
The InChIKey is ANDTUSZCYWXNLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO2/c1-3-13-7-9-10(14-4-2)8(11)5-6-12-9/h5-6H,3-4,7H2,1-2H3.
What are the key properties of 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine?
4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine has a molecular weight of 215.68 g/mol, XLogP of 2.67, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-ethoxy-2-(ethoxymethyl)pyridine is sourced from PubChem (CID 19032537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).