2-methyl-1,3-oxazolidin-5-one

C4H7NO2 — CID 19595572

IUPAC2-methyl-1,3-oxazolidin-5-one
SMILESCC1NCC(=O)O1
InChIInChI=1S/C4H7NO2/c1-3-5-2-4(6)7-3/h3,5H,2H2,1H3
InChIKeyQVEAUEQARWVRAV-UHFFFAOYSA-N
MW101.11 g/mol
LogP-0.52
Rot. Bonds

About 2-methyl-1,3-oxazolidin-5-one

2-methyl-1,3-oxazolidin-5-one (PubChem CID 19595572) has the molecular formula C4H7NO2 and a molecular weight of 101.11 g/mol. Its IUPAC name is 2-methyl-1,3-oxazolidin-5-one.

Molecular Properties

Compound Name2-methyl-1,3-oxazolidin-5-one
PubChem CID19595572
Molecular FormulaC4H7NO2
Molecular Weight101.11 g/mol
Exact Mass101.05
IUPAC Name2-methyl-1,3-oxazolidin-5-one
SMILESCC1NCC(=O)O1
InChIInChI=1S/C4H7NO2/c1-3-5-2-4(6)7-3/h3,5H,2H2,1H3
InChIKeyQVEAUEQARWVRAV-UHFFFAOYSA-N
XLogP-0.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.11
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl 2-(ethylamino)acetate
CID 12591597
Ethyl 2-[(2-methoxyethyl)amino]acetate
CID 15818815
5-Oxazolidinone
CID 20510163
5-Oxazolidinone, 2-(1,1-dimethylethyl)-
CID 55299897
2-(Trifluoromethyl)-1,3-oxazolidin-5-one
CID 21656125
2-(Fluoromethyl)-1,3-oxazolidin-5-one
CID 141058259
2-Ethyl-1,3-oxazolidin-5-one
CID 18801026
2-(Hydroxymethyl)-1,3-oxazolidin-5-one
CID 20275903
2,4-Dimethyl-1,3-oxazolidin-5-one
CID 23529460
Methyl 1,3-oxazolidine-2-carboxylate
CID 53999762
3-Methyl-1,3-oxazolidin-3-ium-5-one
CID 54519496
2,2-Dimethyl-1,3-oxazolidin-5-one
CID 55288080

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3-oxazolidin-5-one?
The IUPAC name of 2-methyl-1,3-oxazolidin-5-one (CID 19595572) is 2-methyl-1,3-oxazolidin-5-one.
What is the SMILES notation for 2-methyl-1,3-oxazolidin-5-one?
The canonical SMILES for 2-methyl-1,3-oxazolidin-5-one is CC1NCC(=O)O1.
What is the InChIKey of 2-methyl-1,3-oxazolidin-5-one?
The InChIKey is QVEAUEQARWVRAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO2/c1-3-5-2-4(6)7-3/h3,5H,2H2,1H3.
What are the key properties of 2-methyl-1,3-oxazolidin-5-one?
2-methyl-1,3-oxazolidin-5-one has a molecular weight of 101.11 g/mol, XLogP of -0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3-oxazolidin-5-one is sourced from PubChem (CID 19595572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).