4-(deuterioamino)-1,2-oxazolidin-3-one

C3H6N2O2 — CID 57288141

IUPAC4-(deuterioamino)-1,2-oxazolidin-3-one
SMILES[2H]NC1CONC1=O
InChIInChI=1S/C3H6N2O2/c4-2-1-7-5-3(2)6/h2H,1,4H2,(H,5,6)/i/hD
InChIKeyDYDCUQKUCUHJBH-DYCDLGHISA-N
MW103.10 g/mol
LogP-1.62
Rot. Bonds1

About 4-(deuterioamino)-1,2-oxazolidin-3-one

4-(deuterioamino)-1,2-oxazolidin-3-one (PubChem CID 57288141) has the molecular formula C3H6N2O2 and a molecular weight of 103.10 g/mol. Its IUPAC name is 4-(deuterioamino)-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name4-(deuterioamino)-1,2-oxazolidin-3-one
PubChem CID57288141
Molecular FormulaC3H6N2O2
Molecular Weight103.10 g/mol
Exact Mass103.05
IUPAC Name4-(deuterioamino)-1,2-oxazolidin-3-one
SMILES[2H]NC1CONC1=O
InChIInChI=1S/C3H6N2O2/c4-2-1-7-5-3(2)6/h2H,1,4H2,(H,5,6)/i/hD
InChIKeyDYDCUQKUCUHJBH-DYCDLGHISA-N
XLogP-1.62
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.10
LogP ≤ 5-1.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(deuterioamino)-1,2-oxazolidin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(deuterioamino)-1,2-oxazolidin-3-one?
The IUPAC name of 4-(deuterioamino)-1,2-oxazolidin-3-one (CID 57288141) is 4-(deuterioamino)-1,2-oxazolidin-3-one.
What is the SMILES notation for 4-(deuterioamino)-1,2-oxazolidin-3-one?
The canonical SMILES for 4-(deuterioamino)-1,2-oxazolidin-3-one is [2H]NC1CONC1=O.
What is the InChIKey of 4-(deuterioamino)-1,2-oxazolidin-3-one?
The InChIKey is DYDCUQKUCUHJBH-DYCDLGHISA-N. The full InChI is InChI=1S/C3H6N2O2/c4-2-1-7-5-3(2)6/h2H,1,4H2,(H,5,6)/i/hD.
What are the key properties of 4-(deuterioamino)-1,2-oxazolidin-3-one?
4-(deuterioamino)-1,2-oxazolidin-3-one has a molecular weight of 103.10 g/mol, XLogP of -1.62, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(deuterioamino)-1,2-oxazolidin-3-one is sourced from PubChem (CID 57288141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).