2-(methoxymethoxymethyl)-4-methylpyridin-3-amine

C9H14N2O2 — CID 102164115

IUPAC2-(methoxymethoxymethyl)-4-methylpyridin-3-amine
SMILESCOCOCc1nccc(C)c1N
InChIInChI=1S/C9H14N2O2/c1-7-3-4-11-8(9(7)10)5-13-6-12-2/h3-4H,5-6,10H2,1-2H3
InChIKeyDOLVIIQLVOQIIX-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.09
Rot. Bonds4

About 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine

2-(methoxymethoxymethyl)-4-methylpyridin-3-amine (PubChem CID 102164115) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine.

Molecular Properties

Compound Name2-(methoxymethoxymethyl)-4-methylpyridin-3-amine
PubChem CID102164115
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2-(methoxymethoxymethyl)-4-methylpyridin-3-amine
SMILESCOCOCc1nccc(C)c1N
InChIInChI=1S/C9H14N2O2/c1-7-3-4-11-8(9(7)10)5-13-6-12-2/h3-4H,5-6,10H2,1-2H3
InChIKeyDOLVIIQLVOQIIX-UHFFFAOYSA-N
XLogP1.09
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(methoxymethoxymethyl)-4-methylpyridin-3-amine?
The IUPAC name of 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine (CID 102164115) is 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine.
What is the SMILES notation for 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine?
The canonical SMILES for 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine is COCOCc1nccc(C)c1N.
What is the InChIKey of 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine?
The InChIKey is DOLVIIQLVOQIIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-7-3-4-11-8(9(7)10)5-13-6-12-2/h3-4H,5-6,10H2,1-2H3.
What are the key properties of 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine?
2-(methoxymethoxymethyl)-4-methylpyridin-3-amine has a molecular weight of 182.22 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethoxymethyl)-4-methylpyridin-3-amine is sourced from PubChem (CID 102164115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).