4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine

C13H21N3O — CID 59244651

IUPAC4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine
SMILESCCCc1c(C)nc(N2CCOCC2)nc1C
InChIInChI=1S/C13H21N3O/c1-4-5-12-10(2)14-13(15-11(12)3)16-6-8-17-9-7-16/h4-9H2,1-3H3
InChIKeyUVOMGOMEEFYAJG-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.88
Rot. Bonds3

About 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine

4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine (PubChem CID 59244651) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine
PubChem CID59244651
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine
SMILESCCCc1c(C)nc(N2CCOCC2)nc1C
InChIInChI=1S/C13H21N3O/c1-4-5-12-10(2)14-13(15-11(12)3)16-6-8-17-9-7-16/h4-9H2,1-3H3
InChIKeyUVOMGOMEEFYAJG-UHFFFAOYSA-N
XLogP1.88
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine?
The IUPAC name of 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine (CID 59244651) is 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine.
What is the SMILES notation for 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine?
The canonical SMILES for 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine is CCCc1c(C)nc(N2CCOCC2)nc1C.
What is the InChIKey of 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine?
The InChIKey is UVOMGOMEEFYAJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-4-5-12-10(2)14-13(15-11(12)3)16-6-8-17-9-7-16/h4-9H2,1-3H3.
What are the key properties of 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine?
4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine has a molecular weight of 235.33 g/mol, XLogP of 1.88, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,6-dimethyl-5-propylpyrimidin-2-yl)morpholine is sourced from PubChem (CID 59244651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).