3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one

C10H10ClNO2 — CID 14268537

IUPAC3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
SMILESCC1COC(=O)N1c1ccc(Cl)cc1
InChIInChI=1S/C10H10ClNO2/c1-7-6-14-10(13)12(7)9-4-2-8(11)3-5-9/h2-5,7H,6H2,1H3
InChIKeyADLMXPHJXKHJSY-UHFFFAOYSA-N
MW211.65 g/mol
LogP2.69
Rot. Bonds1

About 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one

3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one (PubChem CID 14268537) has the molecular formula C10H10ClNO2 and a molecular weight of 211.65 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
PubChem CID14268537
Molecular FormulaC10H10ClNO2
Molecular Weight211.65 g/mol
Exact Mass211.04
IUPAC Name3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
SMILESCC1COC(=O)N1c1ccc(Cl)cc1
InChIInChI=1S/C10H10ClNO2/c1-7-6-14-10(13)12(7)9-4-2-8(11)3-5-9/h2-5,7H,6H2,1H3
InChIKeyADLMXPHJXKHJSY-UHFFFAOYSA-N
XLogP2.69
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one
CID 11429301
4-methyl-3-(4-nitrophenyl)-1,3-oxazolidin-2-one
CID 86166226
(4R)-3-(4-chlorophenyl)-4-ethenyl-1,3-oxazolidin-2-one
CID 134918442
(4R)-3-(3-aminophenyl)-4-methyl-1,3-oxazolidin-2-one
CID 67217943
4-methyl-3-(2-methylquinazolin-7-yl)-1,3-oxazolidin-2-one
CID 162747781
(4S)-3-[4-[2-chloro-3-(2-hydroxy-6-oxopiperidin-3-yl)phenyl]phenyl]-4-methyl-1,3-oxazolidin-2-one
CID 171846242
3-(3-fluoro-4-tritylsulfanylphenyl)-4-methyl-1,3-oxazolidin-2-one
CID 141032225
methyl 3-(4-chlorophenyl)-2-oxo-1,3-oxazinane-4-carboxylate
CID 24976381
(4R)-4-methyl-3-[4-[4-(4-methylbenzoyl)piperidine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one
CID 67381029
(4S)-3-(4-chlorophenyl)-4-(3-phenoxyphenyl)-1,3-oxazolidin-2-one
CID 59485641
methyl 4-[[3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]methoxy]benzoate
CID 18997214
3-[2-(aminomethyl)phenyl]-4-methyl-1,3-oxazolidin-2-one
CID 105458812

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one (CID 14268537) is 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one is CC1COC(=O)N1c1ccc(Cl)cc1.
What is the InChIKey of 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
The InChIKey is ADLMXPHJXKHJSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNO2/c1-7-6-14-10(13)12(7)9-4-2-8(11)3-5-9/h2-5,7H,6H2,1H3.
What are the key properties of 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one?
3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one has a molecular weight of 211.65 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 14268537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).