5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one

C16H22N2O3 — CID 174277904

IUPAC5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one
SMILESCOC1OC(=O)N(c2ccc(N3CCCCC3)cc2)C1C
InChIInChI=1S/C16H22N2O3/c1-12-15(20-2)21-16(19)18(12)14-8-6-13(7-9-14)17-10-4-3-5-11-17/h6-9,12,15H,3-5,10-11H2,1-2H3
InChIKeyQKCBPFLYNRUISG-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.99
Rot. Bonds3

About 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one

5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one (PubChem CID 174277904) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one
PubChem CID174277904
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one
SMILESCOC1OC(=O)N(c2ccc(N3CCCCC3)cc2)C1C
InChIInChI=1S/C16H22N2O3/c1-12-15(20-2)21-16(19)18(12)14-8-6-13(7-9-14)17-10-4-3-5-11-17/h6-9,12,15H,3-5,10-11H2,1-2H3
InChIKeyQKCBPFLYNRUISG-UHFFFAOYSA-N
XLogP2.99
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-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

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one (CID 174277904) is 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one is COC1OC(=O)N(c2ccc(N3CCCCC3)cc2)C1C.
What is the InChIKey of 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one?
The InChIKey is QKCBPFLYNRUISG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-12-15(20-2)21-16(19)18(12)14-8-6-13(7-9-14)17-10-4-3-5-11-17/h6-9,12,15H,3-5,10-11H2,1-2H3.
What are the key properties of 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one?
5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one has a molecular weight of 290.36 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-methyl-3-(4-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 174277904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).