N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide

C8H19N3O3S — CID 141206784

IUPACN-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide
SMILESCNCCN(C)C(=O)CCCS(N)(=O)=O
InChIInChI=1S/C8H19N3O3S/c1-10-5-6-11(2)8(12)4-3-7-15(9,13)14/h10H,3-7H2,1-2H3,(H2,9,13,14)
InChIKeyBLIQUGRWGGHPLX-UHFFFAOYSA-N
MW237.32 g/mol
LogP-1.27
Rot. Bonds7

About N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide

N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide (PubChem CID 141206784) has the molecular formula C8H19N3O3S and a molecular weight of 237.32 g/mol. Its IUPAC name is N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide.

Molecular Properties

Compound NameN-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide
PubChem CID141206784
Molecular FormulaC8H19N3O3S
Molecular Weight237.32 g/mol
Exact Mass237.11
IUPAC NameN-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide
SMILESCNCCN(C)C(=O)CCCS(N)(=O)=O
InChIInChI=1S/C8H19N3O3S/c1-10-5-6-11(2)8(12)4-3-7-15(9,13)14/h10H,3-7H2,1-2H3,(H2,9,13,14)
InChIKeyBLIQUGRWGGHPLX-UHFFFAOYSA-N
XLogP-1.27
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 5-1.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-sulfamoylbutanamide
CID 23588047
N-(2-fluoroethyl)-N-methyl-4-(propan-2-ylsulfinylamino)butanamide
CID 89074162
N-ethyl-4-[[2-(methylamino)acetyl]sulfamoyl]butanamide
CID 135037692
4-(acetylsulfamoyl)-N-ethylbutanamide
CID 138964116
4-[acetyl(cyanomethyl)sulfamoyl]-N-ethylbutanamide
CID 138964149
5-Oxo-1-[2-(propan-2-ylamino)ethyl]pyrrolidine-3-sulfonyl fluoride
CID 168713572
1-(2-Acetamidoethyl)-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168713618
1-[2-(Ethylamino)ethyl]-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168713721
1-[2-(2-Aminoethylamino)ethyl]-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168714845
1-[2-[2-(2-Aminoethylamino)ethylamino]ethyl]-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168714846
1-[2-[2-[2-(2-Aminoethylamino)ethylamino]ethylamino]ethyl]-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168714847
N-(1-methyl-5-oxopyrrolidin-3-yl)propane-1-sulfonamide
CID 71789166

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide?
The IUPAC name of N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide (CID 141206784) is N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide.
What is the SMILES notation for N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide?
The canonical SMILES for N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide is CNCCN(C)C(=O)CCCS(N)(=O)=O.
What is the InChIKey of N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide?
The InChIKey is BLIQUGRWGGHPLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O3S/c1-10-5-6-11(2)8(12)4-3-7-15(9,13)14/h10H,3-7H2,1-2H3,(H2,9,13,14).
What are the key properties of N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide?
N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide has a molecular weight of 237.32 g/mol, XLogP of -1.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(methylamino)ethyl]-4-sulfamoylbutanamide is sourced from PubChem (CID 141206784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).