2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide

C10H12N4O3 — CID 117061770

IUPAC2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide
SMILESO=C(Nc1cnccn1)C(=O)N1CCOCC1
InChIInChI=1S/C10H12N4O3/c15-9(13-8-7-11-1-2-12-8)10(16)14-3-5-17-6-4-14/h1-2,7H,3-6H2,(H,12,13,15)
InChIKeyOZYQOHWFHDYAHY-UHFFFAOYSA-N
MW236.23 g/mol
LogP-0.73
Rot. Bonds1

About 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide

2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide (PubChem CID 117061770) has the molecular formula C10H12N4O3 and a molecular weight of 236.23 g/mol. Its IUPAC name is 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide.

Molecular Properties

Compound Name2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide
PubChem CID117061770
Molecular FormulaC10H12N4O3
Molecular Weight236.23 g/mol
Exact Mass236.09
IUPAC Name2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide
SMILESO=C(Nc1cnccn1)C(=O)N1CCOCC1
InChIInChI=1S/C10H12N4O3/c15-9(13-8-7-11-1-2-12-8)10(16)14-3-5-17-6-4-14/h1-2,7H,3-6H2,(H,12,13,15)
InChIKeyOZYQOHWFHDYAHY-UHFFFAOYSA-N
XLogP-0.73
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide?
The IUPAC name of 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide (CID 117061770) is 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide.
What is the SMILES notation for 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide?
The canonical SMILES for 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide is O=C(Nc1cnccn1)C(=O)N1CCOCC1.
What is the InChIKey of 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide?
The InChIKey is OZYQOHWFHDYAHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O3/c15-9(13-8-7-11-1-2-12-8)10(16)14-3-5-17-6-4-14/h1-2,7H,3-6H2,(H,12,13,15).
What are the key properties of 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide?
2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide has a molecular weight of 236.23 g/mol, XLogP of -0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-2-oxo-N-pyrazin-2-ylacetamide is sourced from PubChem (CID 117061770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).