4-[dipropylsulfamoyl(methyl)amino]butanoic acid

C11H24N2O4S — CID 43361581

IUPAC4-[dipropylsulfamoyl(methyl)amino]butanoic acid
SMILESCCCN(CCC)S(=O)(=O)N(C)CCCC(=O)O
InChIInChI=1S/C11H24N2O4S/c1-4-8-13(9-5-2)18(16,17)12(3)10-6-7-11(14)15/h4-10H2,1-3H3,(H,14,15)
InChIKeyABJBFVWHZXIRCA-UHFFFAOYSA-N
MW280.39 g/mol
LogP1.15
Rot. Bonds10

About 4-[dipropylsulfamoyl(methyl)amino]butanoic acid

4-[dipropylsulfamoyl(methyl)amino]butanoic acid (PubChem CID 43361581) has the molecular formula C11H24N2O4S and a molecular weight of 280.39 g/mol. Its IUPAC name is 4-[dipropylsulfamoyl(methyl)amino]butanoic acid.

Molecular Properties

Compound Name4-[dipropylsulfamoyl(methyl)amino]butanoic acid
PubChem CID43361581
Molecular FormulaC11H24N2O4S
Molecular Weight280.39 g/mol
Exact Mass280.15
IUPAC Name4-[dipropylsulfamoyl(methyl)amino]butanoic acid
SMILESCCCN(CCC)S(=O)(=O)N(C)CCCC(=O)O
InChIInChI=1S/C11H24N2O4S/c1-4-8-13(9-5-2)18(16,17)12(3)10-6-7-11(14)15/h4-10H2,1-3H3,(H,14,15)
InChIKeyABJBFVWHZXIRCA-UHFFFAOYSA-N
XLogP1.15
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[dipropylsulfamoyl(methyl)amino]butanoic 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

4-[3-Carboxypropyl(methyl)amino]butanoic acid
CID 20818054
Bis(3-carboxypropyl)-diethylazanium
CID 11687413
Bis(3-carboxypropyl)-diethylazanium hydroxide
CID 87913940
1-Hydroxy-4-[methyl(sulfinato)amino]-1-oxobutane
CID 134606557
4-[3-Carboxypropyl(ethyl)amino]butanoic acid
CID 154143121
4-[3-Carboxypropyl-[5-(dimethylamino)pentyl]amino]butanoic acid
CID 168884766
4-[3-Carboxypropyl(dimethyl)azaniumyl]butanoate
CID 172774369
4-[Ethyl(sulfanyl)amino]butanoic acid
CID 175718837
Acetic acid;4-(diethylamino)butanoic acid
CID 175877215
4-[2-[2-[3-Carboxypropyl(methyl)amino]ethyl-methylamino]ethyl-methylamino]butanoic acid
CID 178687903
4-(Diethylsulfamoylamino)butanoic acid
CID 28783619
4-[Ethyl(methylsulfonyl)amino]butanoic acid
CID 39242296

Frequently Asked Questions

What is the IUPAC name of 4-[dipropylsulfamoyl(methyl)amino]butanoic acid?
The IUPAC name of 4-[dipropylsulfamoyl(methyl)amino]butanoic acid (CID 43361581) is 4-[dipropylsulfamoyl(methyl)amino]butanoic acid.
What is the SMILES notation for 4-[dipropylsulfamoyl(methyl)amino]butanoic acid?
The canonical SMILES for 4-[dipropylsulfamoyl(methyl)amino]butanoic acid is CCCN(CCC)S(=O)(=O)N(C)CCCC(=O)O.
What is the InChIKey of 4-[dipropylsulfamoyl(methyl)amino]butanoic acid?
The InChIKey is ABJBFVWHZXIRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4S/c1-4-8-13(9-5-2)18(16,17)12(3)10-6-7-11(14)15/h4-10H2,1-3H3,(H,14,15).
What are the key properties of 4-[dipropylsulfamoyl(methyl)amino]butanoic acid?
4-[dipropylsulfamoyl(methyl)amino]butanoic acid has a molecular weight of 280.39 g/mol, XLogP of 1.15, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dipropylsulfamoyl(methyl)amino]butanoic acid is sourced from PubChem (CID 43361581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).