2-[dipropylsulfamoyl(ethyl)amino]acetic acid

C10H22N2O4S — CID 54900712

IUPAC2-[dipropylsulfamoyl(ethyl)amino]acetic acid
SMILESCCCN(CCC)S(=O)(=O)N(CC)CC(=O)O
InChIInChI=1S/C10H22N2O4S/c1-4-7-12(8-5-2)17(15,16)11(6-3)9-10(13)14/h4-9H2,1-3H3,(H,13,14)
InChIKeyRCEQAYYQUMGPNF-UHFFFAOYSA-N
MW266.36 g/mol
LogP0.76
Rot. Bonds9

About 2-[dipropylsulfamoyl(ethyl)amino]acetic acid

2-[dipropylsulfamoyl(ethyl)amino]acetic acid (PubChem CID 54900712) has the molecular formula C10H22N2O4S and a molecular weight of 266.36 g/mol. Its IUPAC name is 2-[dipropylsulfamoyl(ethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[dipropylsulfamoyl(ethyl)amino]acetic acid
PubChem CID54900712
Molecular FormulaC10H22N2O4S
Molecular Weight266.36 g/mol
Exact Mass266.13
IUPAC Name2-[dipropylsulfamoyl(ethyl)amino]acetic acid
SMILESCCCN(CCC)S(=O)(=O)N(CC)CC(=O)O
InChIInChI=1S/C10H22N2O4S/c1-4-7-12(8-5-2)17(15,16)11(6-3)9-10(13)14/h4-9H2,1-3H3,(H,13,14)
InChIKeyRCEQAYYQUMGPNF-UHFFFAOYSA-N
XLogP0.76
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[carboxymethyl(diethylsulfamoyl)amino]acetic acid
CID 3615000
2-[carboxymethyl(ethylsulfonyl)amino]acetic acid
CID 23524492
2-[ethyl(propylsulfonyl)amino]acetic acid
CID 61011722
2-[dipropylsulfamoyl(2-hydroxyethyl)amino]ethanol
CID 61233822
2-[[2-(diethylsulfamoyl)acetyl]-propylamino]acetic acid
CID 119205182
N-[[diethylsulfamoyl(methyl)amino]-methylsulfamoyl]-N-propylpropan-1-amine
CID 91320842
2-[azetidin-1-ylsulfonyl(propyl)amino]acetic acid
CID 122071260
2-[2-methoxypropylsulfonyl(propyl)amino]acetic acid
CID 122071284
ethane;2-[ethyl(propyl)amino]acetic acid
CID 143677754
3-[ethyl(methylsulfonyl)amino]propanoic acid
CID 39239435
2-[octyl(sulfo)amino]acetic acid
CID 88730489
2-[(2,6-difluorophenyl)sulfonyl-propylamino]acetic acid
CID 61007874

Frequently Asked Questions

What is the IUPAC name of 2-[dipropylsulfamoyl(ethyl)amino]acetic acid?
The IUPAC name of 2-[dipropylsulfamoyl(ethyl)amino]acetic acid (CID 54900712) is 2-[dipropylsulfamoyl(ethyl)amino]acetic acid.
What is the SMILES notation for 2-[dipropylsulfamoyl(ethyl)amino]acetic acid?
The canonical SMILES for 2-[dipropylsulfamoyl(ethyl)amino]acetic acid is CCCN(CCC)S(=O)(=O)N(CC)CC(=O)O.
What is the InChIKey of 2-[dipropylsulfamoyl(ethyl)amino]acetic acid?
The InChIKey is RCEQAYYQUMGPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O4S/c1-4-7-12(8-5-2)17(15,16)11(6-3)9-10(13)14/h4-9H2,1-3H3,(H,13,14).
What are the key properties of 2-[dipropylsulfamoyl(ethyl)amino]acetic acid?
2-[dipropylsulfamoyl(ethyl)amino]acetic acid has a molecular weight of 266.36 g/mol, XLogP of 0.76, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dipropylsulfamoyl(ethyl)amino]acetic acid is sourced from PubChem (CID 54900712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).