N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide

C13H19N3O3 — CID 91392470

IUPACN-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide
SMILESCCC1CC(C)C(n2ccc(NC(C)=O)nc2=O)O1
InChIInChI=1S/C13H19N3O3/c1-4-10-7-8(2)12(19-10)16-6-5-11(14-9(3)17)15-13(16)18/h5-6,8,10,12H,4,7H2,1-3H3,(H,14,15,17,18)
InChIKeyNRECGXXVJISAKS-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.54
Rot. Bonds3

About N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide

N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide (PubChem CID 91392470) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide
PubChem CID91392470
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide
SMILESCCC1CC(C)C(n2ccc(NC(C)=O)nc2=O)O1
InChIInChI=1S/C13H19N3O3/c1-4-10-7-8(2)12(19-10)16-6-5-11(14-9(3)17)15-13(16)18/h5-6,8,10,12H,4,7H2,1-3H3,(H,14,15,17,18)
InChIKeyNRECGXXVJISAKS-UHFFFAOYSA-N
XLogP1.54
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide?
The IUPAC name of N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide (CID 91392470) is N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide.
What is the SMILES notation for N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide?
The canonical SMILES for N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide is CCC1CC(C)C(n2ccc(NC(C)=O)nc2=O)O1.
What is the InChIKey of N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide?
The InChIKey is NRECGXXVJISAKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-4-10-7-8(2)12(19-10)16-6-5-11(14-9(3)17)15-13(16)18/h5-6,8,10,12H,4,7H2,1-3H3,(H,14,15,17,18).
What are the key properties of N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide?
N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide has a molecular weight of 265.31 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-ethyl-3-methyloxolan-2-yl)-2-oxopyrimidin-4-yl]acetamide is sourced from PubChem (CID 91392470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).