4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine

C10H16N2O3 — CID 104559949

IUPAC4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine
SMILESCOCCOCCOc1ccncc1N
InChIInChI=1S/C10H16N2O3/c1-13-4-5-14-6-7-15-10-2-3-12-8-9(10)11/h2-3,8H,4-7,11H2,1H3
InChIKeyWBINTZFMDMTRIH-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.71
Rot. Bonds7

About 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine

4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine (PubChem CID 104559949) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine.

Molecular Properties

Compound Name4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine
PubChem CID104559949
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine
SMILESCOCCOCCOc1ccncc1N
InChIInChI=1S/C10H16N2O3/c1-13-4-5-14-6-7-15-10-2-3-12-8-9(10)11/h2-3,8H,4-7,11H2,1H3
InChIKeyWBINTZFMDMTRIH-UHFFFAOYSA-N
XLogP0.71
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
The IUPAC name of 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine (CID 104559949) is 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine.
What is the SMILES notation for 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
The canonical SMILES for 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine is COCCOCCOc1ccncc1N.
What is the InChIKey of 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
The InChIKey is WBINTZFMDMTRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-13-4-5-14-6-7-15-10-2-3-12-8-9(10)11/h2-3,8H,4-7,11H2,1H3.
What are the key properties of 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine has a molecular weight of 212.25 g/mol, XLogP of 0.71, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine is sourced from PubChem (CID 104559949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).