4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one

C11H13NO3 — CID 115062397

IUPAC4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one
SMILESCc1ccccc1C1OC(=O)NC1CO
InChIInChI=1S/C11H13NO3/c1-7-4-2-3-5-8(7)10-9(6-13)12-11(14)15-10/h2-5,9-10,13H,6H2,1H3,(H,12,14)
InChIKeyKOXPOXOMCOLLHR-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.14
Rot. Bonds2

About 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one

4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one (PubChem CID 115062397) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one
PubChem CID115062397
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one
SMILESCc1ccccc1C1OC(=O)NC1CO
InChIInChI=1S/C11H13NO3/c1-7-4-2-3-5-8(7)10-9(6-13)12-11(14)15-10/h2-5,9-10,13H,6H2,1H3,(H,12,14)
InChIKeyKOXPOXOMCOLLHR-UHFFFAOYSA-N
XLogP1.14
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(hydroxymethyl)-5-(2-methylphenyl)-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

5-(2-fluorophenyl)-4-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 115062399
(4S,5R)-4-(hydroxymethyl)-5-phenyl-1,3-oxazolidin-2-one
CID 101245141
(4S,5S)-5-(4-chlorophenyl)-4-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 101245138
(4R,5R)-5-cyclohexa-1,5-dien-3-yn-1-yl-4-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 122484692
5-benzyl-4-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 115062429
[(2R,3S)-3-(2-methylphenyl)pyrrolidin-2-yl]methanol
CID 130672690
[(2S,4S,5S)-5-(2-methylphenyl)-2-phenyl-1,3-dioxolan-4-yl]methanol
CID 141385272
ethane;[5-(2-methylphenyl)-2-phenyl-1,3-dioxolan-4-yl]methanol
CID 144861754
4-(2-methylpropyl)-5-phenyl-1,3-oxazolidin-2-one
CID 14553806
6-(2-methylphenyl)-1,3-oxazinan-2-one
CID 69323043
(4S,5R)-4-(chloromethyl)-5-phenyl-1,3-oxazolidin-2-one
CID 102031796
methyl 2-[(4S,5R)-2-oxo-5-phenyl-1,3-oxazolidin-4-yl]acetate
CID 11791154

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one (CID 115062397) is 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one is Cc1ccccc1C1OC(=O)NC1CO.
What is the InChIKey of 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one?
The InChIKey is KOXPOXOMCOLLHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-7-4-2-3-5-8(7)10-9(6-13)12-11(14)15-10/h2-5,9-10,13H,6H2,1H3,(H,12,14).
What are the key properties of 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one?
4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one has a molecular weight of 207.23 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-5-(2-methylphenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 115062397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).