5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione

C9H13N3O3 — CID 66960308

IUPAC5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione
SMILESCc1cn(N2CCOCC2)c(=O)[nH]c1=O
InChIInChI=1S/C9H13N3O3/c1-7-6-12(9(14)10-8(7)13)11-2-4-15-5-3-11/h6H,2-5H2,1H3,(H,10,13,14)
InChIKeyHJHULZHRJNFKLI-UHFFFAOYSA-N
MW211.22 g/mol
LogP-1.19
Rot. Bonds1

About 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione

5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione (PubChem CID 66960308) has the molecular formula C9H13N3O3 and a molecular weight of 211.22 g/mol. Its IUPAC name is 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione
PubChem CID66960308
Molecular FormulaC9H13N3O3
Molecular Weight211.22 g/mol
Exact Mass211.10
IUPAC Name5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione
SMILESCc1cn(N2CCOCC2)c(=O)[nH]c1=O
InChIInChI=1S/C9H13N3O3/c1-7-6-12(9(14)10-8(7)13)11-2-4-15-5-3-11/h6H,2-5H2,1H3,(H,10,13,14)
InChIKeyHJHULZHRJNFKLI-UHFFFAOYSA-N
XLogP-1.19
TPSA67.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 5-1.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione?
The IUPAC name of 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione (CID 66960308) is 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione.
What is the SMILES notation for 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione?
The canonical SMILES for 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione is Cc1cn(N2CCOCC2)c(=O)[nH]c1=O.
What is the InChIKey of 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione?
The InChIKey is HJHULZHRJNFKLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3/c1-7-6-12(9(14)10-8(7)13)11-2-4-15-5-3-11/h6H,2-5H2,1H3,(H,10,13,14).
What are the key properties of 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione?
5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione has a molecular weight of 211.22 g/mol, XLogP of -1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-morpholin-4-ylpyrimidine-2,4-dione is sourced from PubChem (CID 66960308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).