3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one

C16H22N2O3 — CID 115064378

IUPAC3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one
SMILESCOc1ccccc1CN1C(=O)OCC1(C)C1CCNC1
InChIInChI=1S/C16H22N2O3/c1-16(13-7-8-17-9-13)11-21-15(19)18(16)10-12-5-3-4-6-14(12)20-2/h3-6,13,17H,7-11H2,1-2H3
InChIKeyWODNKHXFQJZNRG-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.02
Rot. Bonds4

About 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one

3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one (PubChem CID 115064378) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one
PubChem CID115064378
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one
SMILESCOc1ccccc1CN1C(=O)OCC1(C)C1CCNC1
InChIInChI=1S/C16H22N2O3/c1-16(13-7-8-17-9-13)11-21-15(19)18(16)10-12-5-3-4-6-14(12)20-2/h3-6,13,17H,7-11H2,1-2H3
InChIKeyWODNKHXFQJZNRG-UHFFFAOYSA-N
XLogP2.02
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one 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

4-methyl-3-[(2-methylphenyl)methyl]-4-piperidin-4-yl-1,3-oxazolidin-2-one
CID 115064180
3-(4-fluorophenyl)-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one
CID 115064333
N-[(2-methoxyphenyl)methyl]pyrrolidine-3-sulfonamide
CID 65422417
(2R)-1-[(2-methoxyphenyl)methyl]-2-methylpiperazine
CID 82755826
2-[(2S)-1-[(2-methoxyphenyl)methyl]piperazin-2-yl]ethanol
CID 95169826
6-ethyl-1-[(2-methoxyphenyl)methyl]-3,6-dimethylpiperazine-2,5-dione
CID 64874307
1-(2-methoxyphenyl)-3-pyrrolidin-3-ylpropan-2-one
CID 116583565
5-(aminomethyl)-3-[(2-methoxyphenyl)methyl]-1,3-oxazolidin-2-one
CID 75365946
3-[(2-methoxyphenyl)methoxymethyl]pyrrolidine
CID 53414657
3-[(2-methoxyphenyl)methyl]piperidine
CID 5005916
3-[3-(5-bromo-2-methoxyphenyl)oxetan-3-yl]pyrrolidine
CID 116870863
6-cyclopropyl-1-[(2-methoxyphenyl)methyl]-3-methylpiperazine-2,5-dione
CID 64875276

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one (CID 115064378) is 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one is COc1ccccc1CN1C(=O)OCC1(C)C1CCNC1.
What is the InChIKey of 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The InChIKey is WODNKHXFQJZNRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-16(13-7-8-17-9-13)11-21-15(19)18(16)10-12-5-3-4-6-14(12)20-2/h3-6,13,17H,7-11H2,1-2H3.
What are the key properties of 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one has a molecular weight of 290.36 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxyphenyl)methyl]-4-methyl-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 115064378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).