3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide

C12H13ClN2O3 — CID 110710353

IUPAC3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
SMILESCN1CC(CNC(=O)c2cccc(Cl)c2)OC1=O
InChIInChI=1S/C12H13ClN2O3/c1-15-7-10(18-12(15)17)6-14-11(16)8-3-2-4-9(13)5-8/h2-5,10H,6-7H2,1H3,(H,14,16)
InChIKeyKAQTVDIXNQMMEL-UHFFFAOYSA-N
MW268.70 g/mol
LogP1.52
Rot. Bonds3

About 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide

3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide (PubChem CID 110710353) has the molecular formula C12H13ClN2O3 and a molecular weight of 268.70 g/mol. Its IUPAC name is 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
PubChem CID110710353
Molecular FormulaC12H13ClN2O3
Molecular Weight268.70 g/mol
Exact Mass268.06
IUPAC Name3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
SMILESCN1CC(CNC(=O)c2cccc(Cl)c2)OC1=O
InChIInChI=1S/C12H13ClN2O3/c1-15-7-10(18-12(15)17)6-14-11(16)8-3-2-4-9(13)5-8/h2-5,10H,6-7H2,1H3,(H,14,16)
InChIKeyKAQTVDIXNQMMEL-UHFFFAOYSA-N
XLogP1.52
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.70
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(dimethylamino)-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110741562
N-[[(5S)-3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-3-fluorobenzamide
CID 40926357
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-3-methoxybenzamide
CID 16921029
N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]pyridine-4-carboxamide
CID 110710356
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-methylbenzamide
CID 16921024
2-(2-chlorophenyl)-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]acetamide
CID 110710393
N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]pyridine-2-carboxamide
CID 110741555
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-1,3-benzodioxole-5-carboxamide
CID 16921039
2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110710361
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-2-methylbenzamide
CID 16921022
3-fluoro-N-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110725933
3-chloro-N-[[4-(3-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367650

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
The IUPAC name of 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide (CID 110710353) is 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide.
What is the SMILES notation for 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
The canonical SMILES for 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide is CN1CC(CNC(=O)c2cccc(Cl)c2)OC1=O.
What is the InChIKey of 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
The InChIKey is KAQTVDIXNQMMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O3/c1-15-7-10(18-12(15)17)6-14-11(16)8-3-2-4-9(13)5-8/h2-5,10H,6-7H2,1H3,(H,14,16).
What are the key properties of 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide has a molecular weight of 268.70 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide is sourced from PubChem (CID 110710353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).