6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine

C15H22N6O2 — CID 50961545

IUPAC6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine
SMILESCCc1cc(NCc2nnc(CC)o2)nc(N2CCOCC2)n1
InChIInChI=1S/C15H22N6O2/c1-3-11-9-12(16-10-14-20-19-13(4-2)23-14)18-15(17-11)21-5-7-22-8-6-21/h9H,3-8,10H2,1-2H3,(H,16,17,18)
InChIKeyXZEMTWKZTFSBSL-UHFFFAOYSA-N
MW318.38 g/mol
LogP1.43
Rot. Bonds6

About 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine

6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine (PubChem CID 50961545) has the molecular formula C15H22N6O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine
PubChem CID50961545
Molecular FormulaC15H22N6O2
Molecular Weight318.38 g/mol
Exact Mass318.18
IUPAC Name6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine
SMILESCCc1cc(NCc2nnc(CC)o2)nc(N2CCOCC2)n1
InChIInChI=1S/C15H22N6O2/c1-3-11-9-12(16-10-14-20-19-13(4-2)23-14)18-15(17-11)21-5-7-22-8-6-21/h9H,3-8,10H2,1-2H3,(H,16,17,18)
InChIKeyXZEMTWKZTFSBSL-UHFFFAOYSA-N
XLogP1.43
TPSA89.20 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine 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 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine (CID 50961545) is 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine is CCc1cc(NCc2nnc(CC)o2)nc(N2CCOCC2)n1.
What is the InChIKey of 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine?
The InChIKey is XZEMTWKZTFSBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6O2/c1-3-11-9-12(16-10-14-20-19-13(4-2)23-14)18-15(17-11)21-5-7-22-8-6-21/h9H,3-8,10H2,1-2H3,(H,16,17,18).
What are the key properties of 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine?
6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine has a molecular weight of 318.38 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-morpholin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 50961545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).