ethyl N-(phenacylsulfamoyl)carbamate

C11H14N2O5S — CID 114463715

IUPACethyl N-(phenacylsulfamoyl)carbamate
SMILESCCOC(=O)NS(=O)(=O)NCC(=O)c1ccccc1
InChIInChI=1S/C11H14N2O5S/c1-2-18-11(15)13-19(16,17)12-8-10(14)9-6-4-3-5-7-9/h3-7,12H,2,8H2,1H3,(H,13,15)
InChIKeyFPIAGAZRJLNEAD-UHFFFAOYSA-N
MW286.31 g/mol
LogP0.45
Rot. Bonds6

About ethyl N-(phenacylsulfamoyl)carbamate

ethyl N-(phenacylsulfamoyl)carbamate (PubChem CID 114463715) has the molecular formula C11H14N2O5S and a molecular weight of 286.31 g/mol. Its IUPAC name is ethyl N-(phenacylsulfamoyl)carbamate.

Molecular Properties

Compound Nameethyl N-(phenacylsulfamoyl)carbamate
PubChem CID114463715
Molecular FormulaC11H14N2O5S
Molecular Weight286.31 g/mol
Exact Mass286.06
IUPAC Nameethyl N-(phenacylsulfamoyl)carbamate
SMILESCCOC(=O)NS(=O)(=O)NCC(=O)c1ccccc1
InChIInChI=1S/C11H14N2O5S/c1-2-18-11(15)13-19(16,17)12-8-10(14)9-6-4-3-5-7-9/h3-7,12H,2,8H2,1H3,(H,13,15)
InChIKeyFPIAGAZRJLNEAD-UHFFFAOYSA-N
XLogP0.45
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl N-[(2-hydroxy-2-phenylethyl)sulfamoyl]carbamate
CID 114464098
2-(2-methoxyethylsulfamoylamino)-1-phenylethanone
CID 114815339
N-(ethylsulfamoyl)benzamide
CID 154250118
ethyl N-[(1-chloro-2-phenylpropan-2-yl)sulfamoyl]carbamate
CID 105060300
2,2-dimethyl-N-phenacylpropane-1-sulfonamide
CID 64994451
ethyl N-(propylsulfamoyl)carbamate
CID 114463072
ethyl N-[[(1R)-2-hydroxy-1-phenylethyl]sulfamoyl]carbamate
CID 107863586
ethyl N-[(2-bromo-1-phenylethyl)sulfamoyl]carbamate
CID 114466749
ethyl N-[[3-[(Z)-N'-hydroxycarbamimidoyl]phenyl]methylsulfamoyl]carbamate
CID 114465943
CID 6332799
CID 6332799
ethyl N-(2-chloroethylsulfamoyl)carbamate
CID 114464062
ethyl (2S)-2-(benzylsulfamoylcarbamoyloxy)propanoate
CID 10758791

Frequently Asked Questions

What is the IUPAC name of ethyl N-(phenacylsulfamoyl)carbamate?
The IUPAC name of ethyl N-(phenacylsulfamoyl)carbamate (CID 114463715) is ethyl N-(phenacylsulfamoyl)carbamate.
What is the SMILES notation for ethyl N-(phenacylsulfamoyl)carbamate?
The canonical SMILES for ethyl N-(phenacylsulfamoyl)carbamate is CCOC(=O)NS(=O)(=O)NCC(=O)c1ccccc1.
What is the InChIKey of ethyl N-(phenacylsulfamoyl)carbamate?
The InChIKey is FPIAGAZRJLNEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O5S/c1-2-18-11(15)13-19(16,17)12-8-10(14)9-6-4-3-5-7-9/h3-7,12H,2,8H2,1H3,(H,13,15).
What are the key properties of ethyl N-(phenacylsulfamoyl)carbamate?
ethyl N-(phenacylsulfamoyl)carbamate has a molecular weight of 286.31 g/mol, XLogP of 0.45, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(phenacylsulfamoyl)carbamate is sourced from PubChem (CID 114463715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).