3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione

C12H20N2O4 — CID 3029644

IUPAC3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione
SMILESCC1CN(CCCN2C(=O)COC2=O)CC(C)O1
InChIInChI=1S/C12H20N2O4/c1-9-6-13(7-10(2)18-9)4-3-5-14-11(15)8-17-12(14)16/h9-10H,3-8H2,1-2H3
InChIKeyQCSHFRTVTDMHIK-UHFFFAOYSA-N
MW256.30 g/mol
LogP0.46
Rot. Bonds4

About 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione

3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione (PubChem CID 3029644) has the molecular formula C12H20N2O4 and a molecular weight of 256.30 g/mol. Its IUPAC name is 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione
PubChem CID3029644
Molecular FormulaC12H20N2O4
Molecular Weight256.30 g/mol
Exact Mass256.14
IUPAC Name3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione
SMILESCC1CN(CCCN2C(=O)COC2=O)CC(C)O1
InChIInChI=1S/C12H20N2O4/c1-9-6-13(7-10(2)18-9)4-3-5-14-11(15)8-17-12(14)16/h9-10H,3-8H2,1-2H3
InChIKeyQCSHFRTVTDMHIK-UHFFFAOYSA-N
XLogP0.46
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 50.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione with MolForge

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

Launch Full Analysis

Related Compounds

Ammonium, (3-(2,4-dioxo-3-oxazolidinyl)propyl)trimethyl-, iodide
CID 52029
3-(2,4-Dioxo-1,3-oxazolidin-3-yl)propyl-trimethylazanium
CID 52030
4-(3-(2,4-Dioxo-3-oxazolidinyl)propyl)-4-methylmorpholinium iodide
CID 3029465
3-(3-(Dibutylamino)propyl)-5-methyl-2,4-oxazolidinedione
CID 3029635
3-(3-(Diethylamino)propyl)-5-methyl-2,4-oxazolidinedione
CID 3029637
3-(3-(Dimethylamino)propyl)-5-methyl-2,4-oxazolidinedione
CID 3029639
5,5-Dimethyl-3-(3-(4-morpholinyl)propyl)-2,4-oxazolidinedione
CID 3029645
N,N-Diethyl-2,4-dioxo-N-methyl-3-oxazolidinepropanaminium iodide
CID 11971983
4-[4-(4-Oxo-1,3-oxazolidin-3-yl)butan-2-yl]morpholin-3-one
CID 18374161
4-[3-(4-Oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one
CID 18374166
Methyl 2-[di(propan-2-yl)carbamoyl]morpholine-4-carboxylate
CID 22958998
t-Butyl 2-[(diethylamino)carbonyl]morpholine-4-carboxylate
CID 23112247

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione?
The IUPAC name of 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione (CID 3029644) is 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione is CC1CN(CCCN2C(=O)COC2=O)CC(C)O1.
What is the InChIKey of 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione?
The InChIKey is QCSHFRTVTDMHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O4/c1-9-6-13(7-10(2)18-9)4-3-5-14-11(15)8-17-12(14)16/h9-10H,3-8H2,1-2H3.
What are the key properties of 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione?
3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione has a molecular weight of 256.30 g/mol, XLogP of 0.46, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2,6-dimethylmorpholin-4-yl)propyl]-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 3029644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).