2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol

C10H15NO3 — CID 114937958

IUPAC2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol
SMILESCCOCC(O)c1ccc(OC)nc1
InChIInChI=1S/C10H15NO3/c1-3-14-7-9(12)8-4-5-10(13-2)11-6-8/h4-6,9,12H,3,7H2,1-2H3
InChIKeyFCIQZEOAKHENCL-UHFFFAOYSA-N
MW197.23 g/mol
LogP1.16
Rot. Bonds5

About 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol

2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol (PubChem CID 114937958) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol.

Molecular Properties

Compound Name2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol
PubChem CID114937958
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol
SMILESCCOCC(O)c1ccc(OC)nc1
InChIInChI=1S/C10H15NO3/c1-3-14-7-9(12)8-4-5-10(13-2)11-6-8/h4-6,9,12H,3,7H2,1-2H3
InChIKeyFCIQZEOAKHENCL-UHFFFAOYSA-N
XLogP1.16
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol?
The IUPAC name of 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol (CID 114937958) is 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol.
What is the SMILES notation for 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol?
The canonical SMILES for 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol is CCOCC(O)c1ccc(OC)nc1.
What is the InChIKey of 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol?
The InChIKey is FCIQZEOAKHENCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-3-14-7-9(12)8-4-5-10(13-2)11-6-8/h4-6,9,12H,3,7H2,1-2H3.
What are the key properties of 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol?
2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol has a molecular weight of 197.23 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(6-methoxy-3-pyridinyl)ethanol is sourced from PubChem (CID 114937958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).