2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine

C10H16N4O — CID 121204972

IUPAC2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine
SMILESCOC1CN(c2nc(C)c(N)c(C)n2)C1
InChIInChI=1S/C10H16N4O/c1-6-9(11)7(2)13-10(12-6)14-4-8(5-14)15-3/h8H,4-5,11H2,1-3H3
InChIKeyUFOSTTVXQLYLRH-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.51
Rot. Bonds2

About 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine

2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine (PubChem CID 121204972) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine.

Molecular Properties

Compound Name2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine
PubChem CID121204972
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine
SMILESCOC1CN(c2nc(C)c(N)c(C)n2)C1
InChIInChI=1S/C10H16N4O/c1-6-9(11)7(2)13-10(12-6)14-4-8(5-14)15-3/h8H,4-5,11H2,1-3H3
InChIKeyUFOSTTVXQLYLRH-UHFFFAOYSA-N
XLogP0.51
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine?
The IUPAC name of 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine (CID 121204972) is 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine.
What is the SMILES notation for 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine?
The canonical SMILES for 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine is COC1CN(c2nc(C)c(N)c(C)n2)C1.
What is the InChIKey of 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine?
The InChIKey is UFOSTTVXQLYLRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-9(11)7(2)13-10(12-6)14-4-8(5-14)15-3/h8H,4-5,11H2,1-3H3.
What are the key properties of 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine?
2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine has a molecular weight of 208.26 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyazetidin-1-yl)-4,6-dimethylpyrimidin-5-amine is sourced from PubChem (CID 121204972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).