3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one

C9H16N2O3 — CID 142174603

IUPAC3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one
SMILESCN1CCCC1=O.CN1CCOC1=O
InChIInChI=1S/C5H9NO.C4H7NO2/c1-6-4-2-3-5(6)7;1-5-2-3-7-4(5)6/h2-4H2,1H3;2-3H2,1H3
InChIKeyKKWKHXZFGDWAMW-UHFFFAOYSA-N
MW200.24 g/mol
LogP0.31
Rot. Bonds

About 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one

3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one (PubChem CID 142174603) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one.

Molecular Properties

Compound Name3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one
PubChem CID142174603
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one
SMILESCN1CCCC1=O.CN1CCOC1=O
InChIInChI=1S/C5H9NO.C4H7NO2/c1-6-4-2-3-5(6)7;1-5-2-3-7-4(5)6/h2-4H2,1H3;2-3H2,1H3
InChIKeyKKWKHXZFGDWAMW-UHFFFAOYSA-N
XLogP0.31
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
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 ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one?
The IUPAC name of 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one (CID 142174603) is 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one.
What is the SMILES notation for 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one?
The canonical SMILES for 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one is CN1CCCC1=O.CN1CCOC1=O.
What is the InChIKey of 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one?
The InChIKey is KKWKHXZFGDWAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.C4H7NO2/c1-6-4-2-3-5(6)7;1-5-2-3-7-4(5)6/h2-4H2,1H3;2-3H2,1H3.
What are the key properties of 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one?
3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one has a molecular weight of 200.24 g/mol, XLogP of 0.31, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,3-oxazolidin-2-one;1-methylpyrrolidin-2-one is sourced from PubChem (CID 142174603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).