3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione

C11H20N2O3 — CID 3029637

IUPAC3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione
SMILESCCN(CC)CCCN1C(=O)OC(C)C1=O
InChIInChI=1S/C11H20N2O3/c1-4-12(5-2)7-6-8-13-10(14)9(3)16-11(13)15/h9H,4-8H2,1-3H3
InChIKeyDGXVQCRTKHJRLM-UHFFFAOYSA-N
MW228.29 g/mol
LogP1.09
Rot. Bonds6

About 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione

3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione (PubChem CID 3029637) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione
PubChem CID3029637
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione
SMILESCCN(CC)CCCN1C(=O)OC(C)C1=O
InChIInChI=1S/C11H20N2O3/c1-4-12(5-2)7-6-8-13-10(14)9(3)16-11(13)15/h9H,4-8H2,1-3H3
InChIKeyDGXVQCRTKHJRLM-UHFFFAOYSA-N
XLogP1.09
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione (CID 3029637) is 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione is CCN(CC)CCCN1C(=O)OC(C)C1=O.
What is the InChIKey of 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
The InChIKey is DGXVQCRTKHJRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-4-12(5-2)7-6-8-13-10(14)9(3)16-11(13)15/h9H,4-8H2,1-3H3.
What are the key properties of 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione has a molecular weight of 228.29 g/mol, XLogP of 1.09, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(diethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 3029637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).