2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide

C13H20N4O2 — CID 53201755

IUPAC2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide
SMILESCCc1cc(=O)n(CC(=O)NC2CCCC2)c(N)n1
InChIInChI=1S/C13H20N4O2/c1-2-9-7-12(19)17(13(14)16-9)8-11(18)15-10-5-3-4-6-10/h7,10H,2-6,8H2,1H3,(H2,14,16)(H,15,18)
InChIKeyPXUJEUPUVJFDRD-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.45
Rot. Bonds4

About 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide

2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide (PubChem CID 53201755) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide
PubChem CID53201755
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide
SMILESCCc1cc(=O)n(CC(=O)NC2CCCC2)c(N)n1
InChIInChI=1S/C13H20N4O2/c1-2-9-7-12(19)17(13(14)16-9)8-11(18)15-10-5-3-4-6-10/h7,10H,2-6,8H2,1H3,(H2,14,16)(H,15,18)
InChIKeyPXUJEUPUVJFDRD-UHFFFAOYSA-N
XLogP0.45
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide?
The IUPAC name of 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide (CID 53201755) is 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide.
What is the SMILES notation for 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide?
The canonical SMILES for 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide is CCc1cc(=O)n(CC(=O)NC2CCCC2)c(N)n1.
What is the InChIKey of 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide?
The InChIKey is PXUJEUPUVJFDRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-2-9-7-12(19)17(13(14)16-9)8-11(18)15-10-5-3-4-6-10/h7,10H,2-6,8H2,1H3,(H2,14,16)(H,15,18).
What are the key properties of 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide?
2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide has a molecular weight of 264.33 g/mol, XLogP of 0.45, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-ethyl-6-oxopyrimidin-1-yl)-N-cyclopentylacetamide is sourced from PubChem (CID 53201755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).