3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one

C17H23NO3 — CID 25173209

IUPAC3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1Cc1ccc(OCC2CCCCC2)cc1
InChIInChI=1S/C17H23NO3/c19-17-18(10-11-20-17)12-14-6-8-16(9-7-14)21-13-15-4-2-1-3-5-15/h6-9,15H,1-5,10-13H2
InChIKeyHLYURPQZLYFESS-UHFFFAOYSA-N
MW289.37 g/mol
LogP3.60
Rot. Bonds5

About 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one

3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one (PubChem CID 25173209) has the molecular formula C17H23NO3 and a molecular weight of 289.37 g/mol. Its IUPAC name is 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one
PubChem CID25173209
Molecular FormulaC17H23NO3
Molecular Weight289.37 g/mol
Exact Mass289.17
IUPAC Name3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1Cc1ccc(OCC2CCCCC2)cc1
InChIInChI=1S/C17H23NO3/c19-17-18(10-11-20-17)12-14-6-8-16(9-7-14)21-13-15-4-2-1-3-5-15/h6-9,15H,1-5,10-13H2
InChIKeyHLYURPQZLYFESS-UHFFFAOYSA-N
XLogP3.60
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.37
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-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 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one (CID 25173209) is 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one is O=C1OCCN1Cc1ccc(OCC2CCCCC2)cc1.
What is the InChIKey of 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one?
The InChIKey is HLYURPQZLYFESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO3/c19-17-18(10-11-20-17)12-14-6-8-16(9-7-14)21-13-15-4-2-1-3-5-15/h6-9,15H,1-5,10-13H2.
What are the key properties of 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one?
3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one has a molecular weight of 289.37 g/mol, XLogP of 3.60, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(cyclohexylmethoxy)phenyl]methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 25173209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).