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

C9H16N2O3 — CID 3029639

IUPAC3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione
SMILESCC1OC(=O)N(CCCN(C)C)C1=O
InChIInChI=1S/C9H16N2O3/c1-7-8(12)11(9(13)14-7)6-4-5-10(2)3/h7H,4-6H2,1-3H3
InChIKeyYCVQQIQKAABSQT-UHFFFAOYSA-N
MW200.24 g/mol
LogP0.31
Rot. Bonds4

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

3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione (PubChem CID 3029639) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione
PubChem CID3029639
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione
SMILESCC1OC(=O)N(CCCN(C)C)C1=O
InChIInChI=1S/C9H16N2O3/c1-7-8(12)11(9(13)14-7)6-4-5-10(2)3/h7H,4-6H2,1-3H3
InChIKeyYCVQQIQKAABSQT-UHFFFAOYSA-N
XLogP0.31
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-Dimethyl-1,3-oxazolidine-2,4-dione
CID 185896
Ammonium, (3-(2,4-dioxo-3-oxazolidinyl)propyl)trimethyl-, iodide
CID 52029
Ethyl-methyl-oxazolidinedione
CID 13892513
3-(2,4-Dioxo-1,3-oxazolidin-3-yl)propyl-trimethylazanium
CID 52030
3-(4-(Dibutylamino)butyl)-2,4-oxazolidinedione
CID 3029634
3-(3-(Dibutylamino)propyl)-5-methyl-2,4-oxazolidinedione
CID 3029635
3-(4-(Diethylamino)butyl)-2,4-oxazolidinedione
CID 3029636
3-(3-(Diethylamino)propyl)-5-methyl-2,4-oxazolidinedione
CID 3029637
3-(3-(2,6-Dimethyl-4-morpholinyl)propyl)-2,4-oxazolidinedione
CID 3029644
5,5-Dimethyl-3-(3-(4-morpholinyl)propyl)-2,4-oxazolidinedione
CID 3029645
2,4-Oxazolidinedione, 3-isobutyl-5-methyl-
CID 3029670
1-(3-(2,4-Dioxo-3-oxazolidinyl)propyl)-1-methylpyrrolidinium iodide
CID 3031601

Frequently Asked Questions

What is the IUPAC name of 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione (CID 3029639) is 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione is CC1OC(=O)N(CCCN(C)C)C1=O.
What is the InChIKey of 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
The InChIKey is YCVQQIQKAABSQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-7-8(12)11(9(13)14-7)6-4-5-10(2)3/h7H,4-6H2,1-3H3.
What are the key properties of 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione?
3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione has a molecular weight of 200.24 g/mol, XLogP of 0.31, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(dimethylamino)propyl]-5-methyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 3029639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).