propylsulfamoyl N-benzylcarbamate

C11H16N2O4S — CID 90890692

IUPACpropylsulfamoyl N-benzylcarbamate
SMILESCCCNS(=O)(=O)OC(=O)NCc1ccccc1
InChIInChI=1S/C11H16N2O4S/c1-2-8-13-18(15,16)17-11(14)12-9-10-6-4-3-5-7-10/h3-7,13H,2,8-9H2,1H3,(H,12,14)
InChIKeyYFPCYYNLASVCFX-UHFFFAOYSA-N
MW272.33 g/mol
LogP1.16
Rot. Bonds6

About propylsulfamoyl N-benzylcarbamate

propylsulfamoyl N-benzylcarbamate (PubChem CID 90890692) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is propylsulfamoyl N-benzylcarbamate.

Molecular Properties

Compound Namepropylsulfamoyl N-benzylcarbamate
PubChem CID90890692
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Namepropylsulfamoyl N-benzylcarbamate
SMILESCCCNS(=O)(=O)OC(=O)NCc1ccccc1
InChIInChI=1S/C11H16N2O4S/c1-2-8-13-18(15,16)17-11(14)12-9-10-6-4-3-5-7-10/h3-7,13H,2,8-9H2,1H3,(H,12,14)
InChIKeyYFPCYYNLASVCFX-UHFFFAOYSA-N
XLogP1.16
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

pentylsulfamoyl N-benzylcarbamate
CID 91389428
2-pyridin-2-ylethylsulfamoyl N-benzylcarbamate
CID 91276890
benzene;ethyl N-benzylcarbamate
CID 67715166
N'-benzyl-N-propylpropanediamide
CID 108940601
N-benzyl-3-(propylsulfamoyl)benzamide
CID 9393602
ethyl (2S)-2-(benzylsulfamoylcarbamoyloxy)propanoate
CID 10758791
benzyl N-[(4-ethylsulfonylphenyl)methyl]carbamate
CID 110784595
propan-2-yl N-(benzylsulfamoyl)carbamate
CID 117060358
1-benzyl-3-propylthiourea
CID 12725927
(4-methylphenyl) N-benzylcarbamate
CID 14292552
[(2S)-1-amino-1-oxopentan-2-yl] N-benzylcarbamate
CID 175581620
2-ethylpentyl N-benzylcarbamate
CID 58269941

Frequently Asked Questions

What is the IUPAC name of propylsulfamoyl N-benzylcarbamate?
The IUPAC name of propylsulfamoyl N-benzylcarbamate (CID 90890692) is propylsulfamoyl N-benzylcarbamate.
What is the SMILES notation for propylsulfamoyl N-benzylcarbamate?
The canonical SMILES for propylsulfamoyl N-benzylcarbamate is CCCNS(=O)(=O)OC(=O)NCc1ccccc1.
What is the InChIKey of propylsulfamoyl N-benzylcarbamate?
The InChIKey is YFPCYYNLASVCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-2-8-13-18(15,16)17-11(14)12-9-10-6-4-3-5-7-10/h3-7,13H,2,8-9H2,1H3,(H,12,14).
What are the key properties of propylsulfamoyl N-benzylcarbamate?
propylsulfamoyl N-benzylcarbamate has a molecular weight of 272.33 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propylsulfamoyl N-benzylcarbamate is sourced from PubChem (CID 90890692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).