[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate

C13H15N3O6S — CID 7740423

IUPAC[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate
SMILESCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)N1CCNC1=O
InChIInChI=1S/C13H15N3O6S/c1-23(20,21)15-10-5-3-2-4-9(10)12(18)22-8-11(17)16-7-6-14-13(16)19/h2-5,15H,6-8H2,1H3,(H,14,19)
InChIKeyZLVRTVJCQRBJST-UHFFFAOYSA-N
MW341.35 g/mol
LogP-0.23
Rot. Bonds5

About [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate

[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate (PubChem CID 7740423) has the molecular formula C13H15N3O6S and a molecular weight of 341.35 g/mol. Its IUPAC name is [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate.

Molecular Properties

Compound Name[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate
PubChem CID7740423
Molecular FormulaC13H15N3O6S
Molecular Weight341.35 g/mol
Exact Mass341.07
IUPAC Name[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate
SMILESCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)N1CCNC1=O
InChIInChI=1S/C13H15N3O6S/c1-23(20,21)15-10-5-3-2-4-9(10)12(18)22-8-11(17)16-7-6-14-13(16)19/h2-5,15H,6-8H2,1H3,(H,14,19)
InChIKeyZLVRTVJCQRBJST-UHFFFAOYSA-N
XLogP-0.23
TPSA121.88 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.35
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate with MolForge

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Related Compounds

1-O-methyl 2-O-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] benzene-1,2-dicarboxylate
CID 56505352
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-ethoxybenzoate
CID 7758181
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(furan-2-ylmethylamino)benzoate
CID 7149855
[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-(methanesulfonamido)benzoate
CID 8015609
[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl] 2-(methanesulfonamido)benzoate
CID 7247709
ethyl 1-[2-[2-(methanesulfonamido)benzoyl]oxyacetyl]piperidine-4-carboxylate
CID 7740885
[2-(butylamino)-2-oxoethyl] 2-(methanesulfonamido)benzoate
CID 7740464
[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] 2-(methylamino)benzoate
CID 55454235
[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] 2-(methanesulfonamido)benzoate
CID 16519219
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-[(2-fluorobenzoyl)amino]acetate
CID 9270042
[2-(ethoxycarbonylamino)-2-oxoethyl] 2-(methanesulfonamido)benzoate
CID 7740541
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] pyridine-4-carboxylate
CID 7783725

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate?
The IUPAC name of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate (CID 7740423) is [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate.
What is the SMILES notation for [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate?
The canonical SMILES for [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate is CS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)N1CCNC1=O.
What is the InChIKey of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate?
The InChIKey is ZLVRTVJCQRBJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O6S/c1-23(20,21)15-10-5-3-2-4-9(10)12(18)22-8-11(17)16-7-6-14-13(16)19/h2-5,15H,6-8H2,1H3,(H,14,19).
What are the key properties of [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate?
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate has a molecular weight of 341.35 g/mol, XLogP of -0.23, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(methanesulfonamido)benzoate is sourced from PubChem (CID 7740423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).