5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one

C9H11N3O3 — CID 110849405

IUPAC5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one
SMILESO=C(c1cnc[nH]c1=O)N1CCOCC1
InChIInChI=1S/C9H11N3O3/c13-8-7(5-10-6-11-8)9(14)12-1-3-15-4-2-12/h5-6H,1-4H2,(H,10,11,13)
InChIKeyZJXXFCNZIXKSEU-UHFFFAOYSA-N
MW209.20 g/mol
LogP-0.76
Rot. Bonds1

About 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one

5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one (PubChem CID 110849405) has the molecular formula C9H11N3O3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one
PubChem CID110849405
Molecular FormulaC9H11N3O3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one
SMILESO=C(c1cnc[nH]c1=O)N1CCOCC1
InChIInChI=1S/C9H11N3O3/c13-8-7(5-10-6-11-8)9(14)12-1-3-15-4-2-12/h5-6H,1-4H2,(H,10,11,13)
InChIKeyZJXXFCNZIXKSEU-UHFFFAOYSA-N
XLogP-0.76
TPSA75.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 5-0.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one?
The IUPAC name of 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one (CID 110849405) is 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one?
The canonical SMILES for 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one is O=C(c1cnc[nH]c1=O)N1CCOCC1.
What is the InChIKey of 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one?
The InChIKey is ZJXXFCNZIXKSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c13-8-7(5-10-6-11-8)9(14)12-1-3-15-4-2-12/h5-6H,1-4H2,(H,10,11,13).
What are the key properties of 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one?
5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one has a molecular weight of 209.20 g/mol, XLogP of -0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(morpholine-4-carbonyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 110849405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).