5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione

C11H17N3O3 — CID 66329715

IUPAC5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione
SMILESCCc1cn(CC2CNCCO2)c(=O)[nH]c1=O
InChIInChI=1S/C11H17N3O3/c1-2-8-6-14(11(16)13-10(8)15)7-9-5-12-3-4-17-9/h6,9,12H,2-5,7H2,1H3,(H,13,15,16)
InChIKeyNBYQQUAMJOCLIA-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.91
Rot. Bonds3

About 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione

5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione (PubChem CID 66329715) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione
PubChem CID66329715
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione
SMILESCCc1cn(CC2CNCCO2)c(=O)[nH]c1=O
InChIInChI=1S/C11H17N3O3/c1-2-8-6-14(11(16)13-10(8)15)7-9-5-12-3-4-17-9/h6,9,12H,2-5,7H2,1H3,(H,13,15,16)
InChIKeyNBYQQUAMJOCLIA-UHFFFAOYSA-N
XLogP-0.91
TPSA76.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-Morpholinylmethyl)-2,4-pyrimidinediol
CID 235247
3-methyl-5-{2-oxo-2-[2-(trifluoromethyl)morpholin-4-yl]ethyl}pyrimidine-2,4(1H,3H)-dione
CID 56877860
3-methyl-5-[2-oxo-2-[(2S)-2-(trifluoromethyl)morpholin-4-yl]ethyl]-1H-pyrimidine-2,4-dione
CID 95557299
3-methyl-5-[2-oxo-2-[(2R)-2-(trifluoromethyl)morpholin-4-yl]ethyl]-1H-pyrimidine-2,4-dione
CID 95557300
1-(6-Ethylmorpholin-2-yl)-5-methylpyrimidine-2,4-dione
CID 60070660
1-[6-(Aminomethyl)morpholin-2-yl]-5-methylpyrimidine-2,4-dione
CID 71036899
1-(2-Ethoxypropyl)-5-methylpyrimidine-2,4-dione
CID 123182378
1-[(6R)-6-ethylmorpholin-2-yl]-5-methylpyrimidine-2,4-dione
CID 135295908
N-[1-(2,6-dimethylmorpholin-4-yl)ethyl]-2-methylprop-2-enamide
CID 139774764
5-methyl-1H-pyrimidine-2,4-dione;morpholine
CID 141070261
1-(6-Ethyl-4-methylmorpholin-2-yl)-5-methylpyrimidine-2,4-dione
CID 167063062
1-[(2R,6R)-6-ethylmorpholin-2-yl]-5-methylpyrimidine-2,4-dione
CID 169962530

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione?
The IUPAC name of 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione (CID 66329715) is 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione.
What is the SMILES notation for 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione?
The canonical SMILES for 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione is CCc1cn(CC2CNCCO2)c(=O)[nH]c1=O.
What is the InChIKey of 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione?
The InChIKey is NBYQQUAMJOCLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-2-8-6-14(11(16)13-10(8)15)7-9-5-12-3-4-17-9/h6,9,12H,2-5,7H2,1H3,(H,13,15,16).
What are the key properties of 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione?
5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione has a molecular weight of 239.27 g/mol, XLogP of -0.91, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-(morpholin-2-ylmethyl)pyrimidine-2,4-dione is sourced from PubChem (CID 66329715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).