2-(dimethoxymethyl)pyridine

C8H11NO2 — CID 10953724

IUPAC2-(dimethoxymethyl)pyridine
SMILESCOC(OC)c1ccccn1
InChIInChI=1S/C8H11NO2/c1-10-8(11-2)7-5-3-4-6-9-7/h3-6,8H,1-2H3
InChIKeyQONJCPHYNRTNME-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.37
Rot. Bonds3

About 2-(dimethoxymethyl)pyridine

2-(dimethoxymethyl)pyridine (PubChem CID 10953724) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 2-(dimethoxymethyl)pyridine.

Molecular Properties

Compound Name2-(dimethoxymethyl)pyridine
PubChem CID10953724
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name2-(dimethoxymethyl)pyridine
SMILESCOC(OC)c1ccccn1
InChIInChI=1S/C8H11NO2/c1-10-8(11-2)7-5-3-4-6-9-7/h3-6,8H,1-2H3
InChIKeyQONJCPHYNRTNME-UHFFFAOYSA-N
XLogP1.37
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethoxymethyl)pyridine?
The IUPAC name of 2-(dimethoxymethyl)pyridine (CID 10953724) is 2-(dimethoxymethyl)pyridine.
What is the SMILES notation for 2-(dimethoxymethyl)pyridine?
The canonical SMILES for 2-(dimethoxymethyl)pyridine is COC(OC)c1ccccn1.
What is the InChIKey of 2-(dimethoxymethyl)pyridine?
The InChIKey is QONJCPHYNRTNME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-10-8(11-2)7-5-3-4-6-9-7/h3-6,8H,1-2H3.
What are the key properties of 2-(dimethoxymethyl)pyridine?
2-(dimethoxymethyl)pyridine has a molecular weight of 153.18 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethoxymethyl)pyridine is sourced from PubChem (CID 10953724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).