2-(1,3-dioxolan-2-ylmethoxy)pyridine

C9H11NO3 — CID 69476681

IUPAC2-(1,3-dioxolan-2-ylmethoxy)pyridine
SMILESc1ccc(OCC2OCCO2)nc1
InChIInChI=1S/C9H11NO3/c1-2-4-10-8(3-1)13-7-9-11-5-6-12-9/h1-4,9H,5-7H2
InChIKeyUWBIVRYBEHFSTF-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.83
Rot. Bonds3

About 2-(1,3-dioxolan-2-ylmethoxy)pyridine

2-(1,3-dioxolan-2-ylmethoxy)pyridine (PubChem CID 69476681) has the molecular formula C9H11NO3 and a molecular weight of 181.19 g/mol. Its IUPAC name is 2-(1,3-dioxolan-2-ylmethoxy)pyridine.

Molecular Properties

Compound Name2-(1,3-dioxolan-2-ylmethoxy)pyridine
PubChem CID69476681
Molecular FormulaC9H11NO3
Molecular Weight181.19 g/mol
Exact Mass181.07
IUPAC Name2-(1,3-dioxolan-2-ylmethoxy)pyridine
SMILESc1ccc(OCC2OCCO2)nc1
InChIInChI=1S/C9H11NO3/c1-2-4-10-8(3-1)13-7-9-11-5-6-12-9/h1-4,9H,5-7H2
InChIKeyUWBIVRYBEHFSTF-UHFFFAOYSA-N
XLogP0.83
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxolan-2-ylmethoxy)pyridine?
The IUPAC name of 2-(1,3-dioxolan-2-ylmethoxy)pyridine (CID 69476681) is 2-(1,3-dioxolan-2-ylmethoxy)pyridine.
What is the SMILES notation for 2-(1,3-dioxolan-2-ylmethoxy)pyridine?
The canonical SMILES for 2-(1,3-dioxolan-2-ylmethoxy)pyridine is c1ccc(OCC2OCCO2)nc1.
What is the InChIKey of 2-(1,3-dioxolan-2-ylmethoxy)pyridine?
The InChIKey is UWBIVRYBEHFSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO3/c1-2-4-10-8(3-1)13-7-9-11-5-6-12-9/h1-4,9H,5-7H2.
What are the key properties of 2-(1,3-dioxolan-2-ylmethoxy)pyridine?
2-(1,3-dioxolan-2-ylmethoxy)pyridine has a molecular weight of 181.19 g/mol, XLogP of 0.83, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxolan-2-ylmethoxy)pyridine is sourced from PubChem (CID 69476681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).