(2-benzamido-2-oxoethyl) 4-acetamidobenzoate

C18H16N2O5 — CID 7949820

IUPAC(2-benzamido-2-oxoethyl) 4-acetamidobenzoate
SMILESCC(=O)Nc1ccc(C(=O)OCC(=O)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C18H16N2O5/c1-12(21)19-15-9-7-14(8-10-15)18(24)25-11-16(22)20-17(23)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,21)(H,20,22,23)
InChIKeyDCYAKCJRWZYERO-UHFFFAOYSA-N
MW340.34 g/mol
LogP1.76
Rot. Bonds5

About (2-benzamido-2-oxoethyl) 4-acetamidobenzoate

(2-benzamido-2-oxoethyl) 4-acetamidobenzoate (PubChem CID 7949820) has the molecular formula C18H16N2O5 and a molecular weight of 340.34 g/mol. Its IUPAC name is (2-benzamido-2-oxoethyl) 4-acetamidobenzoate.

Molecular Properties

Compound Name(2-benzamido-2-oxoethyl) 4-acetamidobenzoate
PubChem CID7949820
Molecular FormulaC18H16N2O5
Molecular Weight340.34 g/mol
Exact Mass340.11
IUPAC Name(2-benzamido-2-oxoethyl) 4-acetamidobenzoate
SMILESCC(=O)Nc1ccc(C(=O)OCC(=O)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C18H16N2O5/c1-12(21)19-15-9-7-14(8-10-15)18(24)25-11-16(22)20-17(23)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,21)(H,20,22,23)
InChIKeyDCYAKCJRWZYERO-UHFFFAOYSA-N
XLogP1.76
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.34
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2-benzamido-2-oxoethyl) 4-[(2-cyanoacetyl)amino]benzoate
CID 7808266
[2-(4-acetamidoanilino)-2-oxoethyl] 4-acetamidobenzoate
CID 7654344
(2-benzamido-2-oxoethyl) 4-(methoxymethyl)benzoate
CID 7488796
[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] 4-acetamidobenzoate
CID 7654320
[2-(2-methylanilino)-2-oxoethyl] 4-acetamidobenzoate
CID 2378879
[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl] 4-acetamidobenzoate
CID 7949789
(2-benzamido-2-oxoethyl) 4-phenylmethoxybenzoate
CID 7264153
[2-oxo-2-(propan-2-ylamino)ethyl] 4-acetamidobenzoate
CID 7654146
[2-(4-acetamidoanilino)-2-oxoethyl] 4-iodobenzoate
CID 2505523
[2-(2-benzylanilino)-2-oxoethyl] 4-acetamidobenzoate
CID 7654106
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate
CID 8646896
[2-oxo-2-[4-(N-propan-2-ylanilino)anilino]ethyl] 4-acetamidobenzoate
CID 2344854

Frequently Asked Questions

What is the IUPAC name of (2-benzamido-2-oxoethyl) 4-acetamidobenzoate?
The IUPAC name of (2-benzamido-2-oxoethyl) 4-acetamidobenzoate (CID 7949820) is (2-benzamido-2-oxoethyl) 4-acetamidobenzoate.
What is the SMILES notation for (2-benzamido-2-oxoethyl) 4-acetamidobenzoate?
The canonical SMILES for (2-benzamido-2-oxoethyl) 4-acetamidobenzoate is CC(=O)Nc1ccc(C(=O)OCC(=O)NC(=O)c2ccccc2)cc1.
What is the InChIKey of (2-benzamido-2-oxoethyl) 4-acetamidobenzoate?
The InChIKey is DCYAKCJRWZYERO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O5/c1-12(21)19-15-9-7-14(8-10-15)18(24)25-11-16(22)20-17(23)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,21)(H,20,22,23).
What are the key properties of (2-benzamido-2-oxoethyl) 4-acetamidobenzoate?
(2-benzamido-2-oxoethyl) 4-acetamidobenzoate has a molecular weight of 340.34 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-benzamido-2-oxoethyl) 4-acetamidobenzoate is sourced from PubChem (CID 7949820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).