(2-benzamido-2-oxoethyl) 2-chlorobenzoate

C16H12ClNO4 — CID 2624247

IUPAC(2-benzamido-2-oxoethyl) 2-chlorobenzoate
SMILESO=C(COC(=O)c1ccccc1Cl)NC(=O)c1ccccc1
InChIInChI=1S/C16H12ClNO4/c17-13-9-5-4-8-12(13)16(21)22-10-14(19)18-15(20)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19,20)
InChIKeyWDYXFASENLYQMC-UHFFFAOYSA-N
MW317.73 g/mol
LogP2.45
Rot. Bonds4

About (2-benzamido-2-oxoethyl) 2-chlorobenzoate

(2-benzamido-2-oxoethyl) 2-chlorobenzoate (PubChem CID 2624247) has the molecular formula C16H12ClNO4 and a molecular weight of 317.73 g/mol. Its IUPAC name is (2-benzamido-2-oxoethyl) 2-chlorobenzoate.

Molecular Properties

Compound Name(2-benzamido-2-oxoethyl) 2-chlorobenzoate
PubChem CID2624247
Molecular FormulaC16H12ClNO4
Molecular Weight317.73 g/mol
Exact Mass317.05
IUPAC Name(2-benzamido-2-oxoethyl) 2-chlorobenzoate
SMILESO=C(COC(=O)c1ccccc1Cl)NC(=O)c1ccccc1
InChIInChI=1S/C16H12ClNO4/c17-13-9-5-4-8-12(13)16(21)22-10-14(19)18-15(20)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19,20)
InChIKeyWDYXFASENLYQMC-UHFFFAOYSA-N
XLogP2.45
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.73
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-benzamido-2-oxoethyl) 2-[(4-chlorobenzoyl)amino]benzoate
CID 30221163
(2-benzamido-2-oxoethyl) 2-[(2-chlorobenzoyl)amino]-4,5-dimethoxybenzoate
CID 42445765
(2-benzamido-2-oxoethyl) 2-hydroxy-3-methylbenzoate
CID 7416144
[2-[(4-tert-butylbenzoyl)amino]-2-oxoethyl] 2,3-dichlorobenzoate
CID 7722764
(2-benzamido-2-oxoethyl) 2-chloro-5-(dimethylsulfamoyl)benzoate
CID 2523778
(2-benzamido-2-oxoethyl) 2,5-dimethylbenzoate
CID 2519727
(2-benzamido-2-oxoethyl) 2-ethoxypyridine-3-carboxylate
CID 7998156
N-[2-(2,4,5-trichlorophenoxy)acetyl]benzamide
CID 2571070
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 2-[(2-chlorophenyl)methoxy]benzoate
CID 2594288
(2-benzamido-2-oxoethyl) 4-chloro-3-methylsulfonylbenzoate
CID 41423260
(2-benzamido-2-oxoethyl) furan-2-carboxylate
CID 7486704
(2-benzamido-2-oxoethyl) pyridine-3-carboxylate
CID 9413804

Frequently Asked Questions

What is the IUPAC name of (2-benzamido-2-oxoethyl) 2-chlorobenzoate?
The IUPAC name of (2-benzamido-2-oxoethyl) 2-chlorobenzoate (CID 2624247) is (2-benzamido-2-oxoethyl) 2-chlorobenzoate.
What is the SMILES notation for (2-benzamido-2-oxoethyl) 2-chlorobenzoate?
The canonical SMILES for (2-benzamido-2-oxoethyl) 2-chlorobenzoate is O=C(COC(=O)c1ccccc1Cl)NC(=O)c1ccccc1.
What is the InChIKey of (2-benzamido-2-oxoethyl) 2-chlorobenzoate?
The InChIKey is WDYXFASENLYQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClNO4/c17-13-9-5-4-8-12(13)16(21)22-10-14(19)18-15(20)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19,20).
What are the key properties of (2-benzamido-2-oxoethyl) 2-chlorobenzoate?
(2-benzamido-2-oxoethyl) 2-chlorobenzoate has a molecular weight of 317.73 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-benzamido-2-oxoethyl) 2-chlorobenzoate is sourced from PubChem (CID 2624247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).