2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide

C17H28N4O4 — CID 16673954

IUPAC2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide
SMILESCCC(CN1CCOCC1)NC(=O)Cc1c(C)nc(OC)nc1OC
InChIInChI=1S/C17H28N4O4/c1-5-13(11-21-6-8-25-9-7-21)19-15(22)10-14-12(2)18-17(24-4)20-16(14)23-3/h13H,5-11H2,1-4H3,(H,19,22)
InChIKeyCVIRXCMRZKSTCH-UHFFFAOYSA-N
MW352.44 g/mol
LogP0.57
Rot. Bonds8

About 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide

2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide (PubChem CID 16673954) has the molecular formula C17H28N4O4 and a molecular weight of 352.44 g/mol. Its IUPAC name is 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide
PubChem CID16673954
Molecular FormulaC17H28N4O4
Molecular Weight352.44 g/mol
Exact Mass352.21
IUPAC Name2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide
SMILESCCC(CN1CCOCC1)NC(=O)Cc1c(C)nc(OC)nc1OC
InChIInChI=1S/C17H28N4O4/c1-5-13(11-21-6-8-25-9-7-21)19-15(22)10-14-12(2)18-17(24-4)20-16(14)23-3/h13H,5-11H2,1-4H3,(H,19,22)
InChIKeyCVIRXCMRZKSTCH-UHFFFAOYSA-N
XLogP0.57
TPSA85.81 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide?
The IUPAC name of 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide (CID 16673954) is 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide?
The canonical SMILES for 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide is CCC(CN1CCOCC1)NC(=O)Cc1c(C)nc(OC)nc1OC.
What is the InChIKey of 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide?
The InChIKey is CVIRXCMRZKSTCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O4/c1-5-13(11-21-6-8-25-9-7-21)19-15(22)10-14-12(2)18-17(24-4)20-16(14)23-3/h13H,5-11H2,1-4H3,(H,19,22).
What are the key properties of 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide?
2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide has a molecular weight of 352.44 g/mol, XLogP of 0.57, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxy-6-methylpyrimidin-5-yl)-N-(1-morpholin-4-ylbutan-2-yl)acetamide is sourced from PubChem (CID 16673954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).