2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine

C10H15N3O — CID 123785027

IUPAC2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine
SMILESCNc1ccnc(N2CC(OC)C2)c1
InChIInChI=1S/C10H15N3O/c1-11-8-3-4-12-10(5-8)13-6-9(7-13)14-2/h3-5,9H,6-7H2,1-2H3,(H,11,12)
InChIKeyZYXPOAUIAAEUFR-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.96
Rot. Bonds3

About 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine

2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine (PubChem CID 123785027) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine.

Molecular Properties

Compound Name2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine
PubChem CID123785027
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine
SMILESCNc1ccnc(N2CC(OC)C2)c1
InChIInChI=1S/C10H15N3O/c1-11-8-3-4-12-10(5-8)13-6-9(7-13)14-2/h3-5,9H,6-7H2,1-2H3,(H,11,12)
InChIKeyZYXPOAUIAAEUFR-UHFFFAOYSA-N
XLogP0.96
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine?
The IUPAC name of 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine (CID 123785027) is 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine.
What is the SMILES notation for 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine?
The canonical SMILES for 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine is CNc1ccnc(N2CC(OC)C2)c1.
What is the InChIKey of 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine?
The InChIKey is ZYXPOAUIAAEUFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-11-8-3-4-12-10(5-8)13-6-9(7-13)14-2/h3-5,9H,6-7H2,1-2H3,(H,11,12).
What are the key properties of 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine?
2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine has a molecular weight of 193.25 g/mol, XLogP of 0.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyazetidin-1-yl)-N-methylpyridin-4-amine is sourced from PubChem (CID 123785027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).