6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione

C7H10N4O3 — CID 5151376

IUPAC6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione
SMILESO=c1nc(N2CCOCC2)[nH]c(=O)[nH]1
InChIInChI=1S/C7H10N4O3/c12-6-8-5(9-7(13)10-6)11-1-3-14-4-2-11/h1-4H2,(H2,8,9,10,12,13)
InChIKeyUZHKDSIOLBEZIH-UHFFFAOYSA-N
MW198.18 g/mol
LogP-1.71
Rot. Bonds1

About 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione

6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione (PubChem CID 5151376) has the molecular formula C7H10N4O3 and a molecular weight of 198.18 g/mol. Its IUPAC name is 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione.

Molecular Properties

Compound Name6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione
PubChem CID5151376
Molecular FormulaC7H10N4O3
Molecular Weight198.18 g/mol
Exact Mass198.08
IUPAC Name6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione
SMILESO=c1nc(N2CCOCC2)[nH]c(=O)[nH]1
InChIInChI=1S/C7H10N4O3/c12-6-8-5(9-7(13)10-6)11-1-3-14-4-2-11/h1-4H2,(H2,8,9,10,12,13)
InChIKeyUZHKDSIOLBEZIH-UHFFFAOYSA-N
XLogP-1.71
TPSA91.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.18
LogP ≤ 5-1.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione?
The IUPAC name of 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione (CID 5151376) is 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione.
What is the SMILES notation for 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione?
The canonical SMILES for 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione is O=c1nc(N2CCOCC2)[nH]c(=O)[nH]1.
What is the InChIKey of 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione?
The InChIKey is UZHKDSIOLBEZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O3/c12-6-8-5(9-7(13)10-6)11-1-3-14-4-2-11/h1-4H2,(H2,8,9,10,12,13).
What are the key properties of 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione?
6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione has a molecular weight of 198.18 g/mol, XLogP of -1.71, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-1H-1,3,5-triazine-2,4-dione is sourced from PubChem (CID 5151376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).