3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione

C10H15N3O3 — CID 4141055

IUPAC3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
SMILESCCn1c(=O)cc(N2CCOCC2)[nH]c1=O
InChIInChI=1S/C10H15N3O3/c1-2-13-9(14)7-8(11-10(13)15)12-3-5-16-6-4-12/h7H,2-6H2,1H3,(H,11,15)
InChIKeyMEDIZKPPNGJXKH-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.61
Rot. Bonds2

About 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione

3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione (PubChem CID 4141055) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
PubChem CID4141055
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione
SMILESCCn1c(=O)cc(N2CCOCC2)[nH]c1=O
InChIInChI=1S/C10H15N3O3/c1-2-13-9(14)7-8(11-10(13)15)12-3-5-16-6-4-12/h7H,2-6H2,1H3,(H,11,15)
InChIKeyMEDIZKPPNGJXKH-UHFFFAOYSA-N
XLogP-0.61
TPSA67.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
The IUPAC name of 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione (CID 4141055) is 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
The canonical SMILES for 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione is CCn1c(=O)cc(N2CCOCC2)[nH]c1=O.
What is the InChIKey of 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
The InChIKey is MEDIZKPPNGJXKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-2-13-9(14)7-8(11-10(13)15)12-3-5-16-6-4-12/h7H,2-6H2,1H3,(H,11,15).
What are the key properties of 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione?
3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione has a molecular weight of 225.25 g/mol, XLogP of -0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-morpholin-4-yl-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 4141055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).