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

C12H13ClN2O3 — CID 110707208

IUPAC3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide
SMILESO=C(NCCN1CCOC1=O)c1cccc(Cl)c1
InChIInChI=1S/C12H13ClN2O3/c13-10-3-1-2-9(8-10)11(16)14-4-5-15-6-7-18-12(15)17/h1-3,8H,4-7H2,(H,14,16)
InChIKeyXVSPTJWMWKQAMN-UHFFFAOYSA-N
MW268.70 g/mol
LogP1.52
Rot. Bonds4

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

3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide (PubChem CID 110707208) has the molecular formula C12H13ClN2O3 and a molecular weight of 268.70 g/mol. Its IUPAC name is 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide
PubChem CID110707208
Molecular FormulaC12H13ClN2O3
Molecular Weight268.70 g/mol
Exact Mass268.06
IUPAC Name3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide
SMILESO=C(NCCN1CCOC1=O)c1cccc(Cl)c1
InChIInChI=1S/C12H13ClN2O3/c13-10-3-1-2-9(8-10)11(16)14-4-5-15-6-7-18-12(15)17/h1-3,8H,4-7H2,(H,14,16)
InChIKeyXVSPTJWMWKQAMN-UHFFFAOYSA-N
XLogP1.52
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179
2-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide
CID 110707207
2,3-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]quinoxaline-6-carboxamide
CID 72852469
3-[2-[4-(3-chlorobenzoyl)piperazin-1-yl]ethyl]-1,3-oxazolidin-2-one
CID 56807735
3-chloro-N-(2-piperidin-1-ylethyl)benzamide
CID 4581034
3-chloro-N-(2-hydroxyethyl)benzamide
CID 2181761
3-chloro-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]benzamide
CID 42266643
3-chloro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide
CID 46537539
3-chloro-N-[2-oxo-2-[2-(2-oxoazepan-1-yl)ethylamino]ethyl]benzamide
CID 55694248
3-chloro-N-[4-(4-ethylpiperazin-1-yl)butyl]benzamide
CID 110442007
3-chloro-N-[2-[(1R,2R,6R,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]ethyl]benzamide
CID 124777490
(3R)-3-(4-chlorophenyl)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-3-phenylpropanamide
CID 42123602

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide?
The IUPAC name of 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide (CID 110707208) is 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide.
What is the SMILES notation for 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide?
The canonical SMILES for 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide is O=C(NCCN1CCOC1=O)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide?
The InChIKey is XVSPTJWMWKQAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O3/c13-10-3-1-2-9(8-10)11(16)14-4-5-15-6-7-18-12(15)17/h1-3,8H,4-7H2,(H,14,16).
What are the key properties of 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide?
3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide has a molecular weight of 268.70 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzamide is sourced from PubChem (CID 110707208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).