4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one

C9H12N4O2 — CID 90417995

IUPAC4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one
SMILESCCNC1COC(=O)N1c1ccncn1
InChIInChI=1S/C9H12N4O2/c1-2-11-8-5-15-9(14)13(8)7-3-4-10-6-12-7/h3-4,6,8,11H,2,5H2,1H3
InChIKeyXYYWQMLEPRYAEX-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.37
Rot. Bonds3

About 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one

4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one (PubChem CID 90417995) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one
PubChem CID90417995
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC Name4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one
SMILESCCNC1COC(=O)N1c1ccncn1
InChIInChI=1S/C9H12N4O2/c1-2-11-8-5-15-9(14)13(8)7-3-4-10-6-12-7/h3-4,6,8,11H,2,5H2,1H3
InChIKeyXYYWQMLEPRYAEX-UHFFFAOYSA-N
XLogP0.37
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one?
The IUPAC name of 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one (CID 90417995) is 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one is CCNC1COC(=O)N1c1ccncn1.
What is the InChIKey of 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one?
The InChIKey is XYYWQMLEPRYAEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2/c1-2-11-8-5-15-9(14)13(8)7-3-4-10-6-12-7/h3-4,6,8,11H,2,5H2,1H3.
What are the key properties of 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one?
4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one has a molecular weight of 208.22 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-3-pyrimidin-4-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 90417995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).