methyl 2-[ethyl(propylsulfamoyl)amino]acetate

C8H18N2O4S — CID 114811544

IUPACmethyl 2-[ethyl(propylsulfamoyl)amino]acetate
SMILESCCCNS(=O)(=O)N(CC)CC(=O)OC
InChIInChI=1S/C8H18N2O4S/c1-4-6-9-15(12,13)10(5-2)7-8(11)14-3/h9H,4-7H2,1-3H3
InChIKeyDQMBVJSPFUKVOF-UHFFFAOYSA-N
MW238.31 g/mol
LogP-0.27
Rot. Bonds7

About methyl 2-[ethyl(propylsulfamoyl)amino]acetate

methyl 2-[ethyl(propylsulfamoyl)amino]acetate (PubChem CID 114811544) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is methyl 2-[ethyl(propylsulfamoyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[ethyl(propylsulfamoyl)amino]acetate
PubChem CID114811544
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC Namemethyl 2-[ethyl(propylsulfamoyl)amino]acetate
SMILESCCCNS(=O)(=O)N(CC)CC(=O)OC
InChIInChI=1S/C8H18N2O4S/c1-4-6-9-15(12,13)10(5-2)7-8(11)14-3/h9H,4-7H2,1-3H3
InChIKeyDQMBVJSPFUKVOF-UHFFFAOYSA-N
XLogP-0.27
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[ethyl(methylsulfamoyl)amino]acetate
CID 114811545
methyl 3-(diethylsulfamoylamino)propanoate
CID 60713707
methyl 2-[cyclopropylsulfamoyl(ethyl)amino]acetate
CID 114383181
ethyl 2-[ethyl(ethylsulfamoyl)amino]acetate
CID 115638420
ethyl 2-[2-methoxyethylsulfamoyl(propyl)amino]acetate
CID 114816314
1-[[2-hydroxyethyl(2-methoxyethyl)sulfamoyl]amino]propane
CID 114809784
ethyl 3-[ethyl-(2-methoxy-2-oxoethyl)sulfamoyl]propanoate
CID 54998323
2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide
CID 114816876
methyl 2-[cyclohexylmethylsulfonyl(ethyl)amino]acetate
CID 54998272
methyl 3-[ethyl(methylsulfamoyl)amino]propanoate
CID 114811511
methyl 2-[(5-chloro-2-methylphenyl)sulfonyl-ethylamino]acetate
CID 54979246
methyl 2-[N-methyl-2-(propylsulfamoyl)anilino]acetate
CID 62005097

Frequently Asked Questions

What is the IUPAC name of methyl 2-[ethyl(propylsulfamoyl)amino]acetate?
The IUPAC name of methyl 2-[ethyl(propylsulfamoyl)amino]acetate (CID 114811544) is methyl 2-[ethyl(propylsulfamoyl)amino]acetate.
What is the SMILES notation for methyl 2-[ethyl(propylsulfamoyl)amino]acetate?
The canonical SMILES for methyl 2-[ethyl(propylsulfamoyl)amino]acetate is CCCNS(=O)(=O)N(CC)CC(=O)OC.
What is the InChIKey of methyl 2-[ethyl(propylsulfamoyl)amino]acetate?
The InChIKey is DQMBVJSPFUKVOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-4-6-9-15(12,13)10(5-2)7-8(11)14-3/h9H,4-7H2,1-3H3.
What are the key properties of methyl 2-[ethyl(propylsulfamoyl)amino]acetate?
methyl 2-[ethyl(propylsulfamoyl)amino]acetate has a molecular weight of 238.31 g/mol, XLogP of -0.27, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[ethyl(propylsulfamoyl)amino]acetate is sourced from PubChem (CID 114811544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).