dipropylsulfamoylcarbamic acid

C7H16N2O4S — CID 141168649

IUPACdipropylsulfamoylcarbamic acid
SMILESCCCN(CCC)S(=O)(=O)NC(=O)O
InChIInChI=1S/C7H16N2O4S/c1-3-5-9(6-4-2)14(12,13)8-7(10)11/h8H,3-6H2,1-2H3,(H,10,11)
InChIKeyJDBINXUBQCLPDS-UHFFFAOYSA-N
MW224.28 g/mol
LogP0.62
Rot. Bonds6

About dipropylsulfamoylcarbamic acid

dipropylsulfamoylcarbamic acid (PubChem CID 141168649) has the molecular formula C7H16N2O4S and a molecular weight of 224.28 g/mol. Its IUPAC name is dipropylsulfamoylcarbamic acid.

Molecular Properties

Compound Namedipropylsulfamoylcarbamic acid
PubChem CID141168649
Molecular FormulaC7H16N2O4S
Molecular Weight224.28 g/mol
Exact Mass224.08
IUPAC Namedipropylsulfamoylcarbamic acid
SMILESCCCN(CCC)S(=O)(=O)NC(=O)O
InChIInChI=1S/C7H16N2O4S/c1-3-5-9(6-4-2)14(12,13)8-7(10)11/h8H,3-6H2,1-2H3,(H,10,11)
InChIKeyJDBINXUBQCLPDS-UHFFFAOYSA-N
XLogP0.62
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze dipropylsulfamoylcarbamic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[ethylsulfonyl(methyl)sulfamoyl]carbamic acid
CID 19814661
ethyl N-[2-chloroethyl(propyl)sulfamoyl]carbamate
CID 114466236
methyl N-[2-hydroxyethyl(propyl)sulfamoyl]carbamate
CID 114464146
2-(dipropylsulfamoylamino)butanoic acid
CID 43470036
(2R)-2-(dipropylsulfamoylamino)-3,3-dimethylbutanoic acid
CID 113353089
1-[propan-2-ylsulfamoyl(propyl)amino]propane
CID 60750604
2-[2-(dipropylsulfamoylamino)ethoxy]acetic acid
CID 79457740
ethyl N-[bis(2-chloroethyl)sulfamoyl]carbamate
CID 114464074
3-[ethyl(methoxycarbonylsulfamoyl)amino]propanoic acid
CID 114462295
6-(dipropylsulfamoylamino)-4,4-dimethylhexanoic acid
CID 65285119
5-(dipropylsulfamoylamino)-3-methylthiophene-2-carboxylic acid
CID 43361342
2-(dipropylsulfamoylamino)-4-methoxybutanoic acid
CID 62479156

Frequently Asked Questions

What is the IUPAC name of dipropylsulfamoylcarbamic acid?
The IUPAC name of dipropylsulfamoylcarbamic acid (CID 141168649) is dipropylsulfamoylcarbamic acid.
What is the SMILES notation for dipropylsulfamoylcarbamic acid?
The canonical SMILES for dipropylsulfamoylcarbamic acid is CCCN(CCC)S(=O)(=O)NC(=O)O.
What is the InChIKey of dipropylsulfamoylcarbamic acid?
The InChIKey is JDBINXUBQCLPDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O4S/c1-3-5-9(6-4-2)14(12,13)8-7(10)11/h8H,3-6H2,1-2H3,(H,10,11).
What are the key properties of dipropylsulfamoylcarbamic acid?
dipropylsulfamoylcarbamic acid has a molecular weight of 224.28 g/mol, XLogP of 0.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dipropylsulfamoylcarbamic acid is sourced from PubChem (CID 141168649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).