2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide

C15H19N5O3S — CID 95922781

IUPAC2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
SMILESCCc1cc(OCC(=O)Nc2nccs2)nc(N2CCOCC2)n1
InChIInChI=1S/C15H19N5O3S/c1-2-11-9-13(19-14(17-11)20-4-6-22-7-5-20)23-10-12(21)18-15-16-3-8-24-15/h3,8-9H,2,4-7,10H2,1H3,(H,16,18,21)
InChIKeyVAYTWUCXUCJSQB-UHFFFAOYSA-N
MW349.42 g/mol
LogP1.35
Rot. Bonds6

About 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide

2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 95922781) has the molecular formula C15H19N5O3S and a molecular weight of 349.42 g/mol. Its IUPAC name is 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
PubChem CID95922781
Molecular FormulaC15H19N5O3S
Molecular Weight349.42 g/mol
Exact Mass349.12
IUPAC Name2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide
SMILESCCc1cc(OCC(=O)Nc2nccs2)nc(N2CCOCC2)n1
InChIInChI=1S/C15H19N5O3S/c1-2-11-9-13(19-14(17-11)20-4-6-22-7-5-20)23-10-12(21)18-15-16-3-8-24-15/h3,8-9H,2,4-7,10H2,1H3,(H,16,18,21)
InChIKeyVAYTWUCXUCJSQB-UHFFFAOYSA-N
XLogP1.35
TPSA89.47 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide (CID 95922781) is 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide is CCc1cc(OCC(=O)Nc2nccs2)nc(N2CCOCC2)n1.
What is the InChIKey of 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is VAYTWUCXUCJSQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3S/c1-2-11-9-13(19-14(17-11)20-4-6-22-7-5-20)23-10-12(21)18-15-16-3-8-24-15/h3,8-9H,2,4-7,10H2,1H3,(H,16,18,21).
What are the key properties of 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide?
2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 349.42 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)oxy-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 95922781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).