4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine

C14H23N3O — CID 126835708

IUPAC4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine
SMILESCCC1CN(c2cc(C)nc(C)n2)C(CC)CO1
InChIInChI=1S/C14H23N3O/c1-5-12-9-18-13(6-2)8-17(12)14-7-10(3)15-11(4)16-14/h7,12-13H,5-6,8-9H2,1-4H3
InChIKeyUHYJQRWKWORXLO-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.49
Rot. Bonds3

About 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine

4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine (PubChem CID 126835708) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine.

Molecular Properties

Compound Name4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine
PubChem CID126835708
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine
SMILESCCC1CN(c2cc(C)nc(C)n2)C(CC)CO1
InChIInChI=1S/C14H23N3O/c1-5-12-9-18-13(6-2)8-17(12)14-7-10(3)15-11(4)16-14/h7,12-13H,5-6,8-9H2,1-4H3
InChIKeyUHYJQRWKWORXLO-UHFFFAOYSA-N
XLogP2.49
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine?
The IUPAC name of 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine (CID 126835708) is 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine.
What is the SMILES notation for 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine?
The canonical SMILES for 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine is CCC1CN(c2cc(C)nc(C)n2)C(CC)CO1.
What is the InChIKey of 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine?
The InChIKey is UHYJQRWKWORXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-5-12-9-18-13(6-2)8-17(12)14-7-10(3)15-11(4)16-14/h7,12-13H,5-6,8-9H2,1-4H3.
What are the key properties of 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine?
4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine has a molecular weight of 249.36 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylpyrimidin-4-yl)-2,5-diethylmorpholine is sourced from PubChem (CID 126835708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).