3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide

C8H19N3O3S — CID 106915137

IUPAC3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide
SMILESCNC(=O)CCN(C)S(=O)(=O)CCCN
InChIInChI=1S/C8H19N3O3S/c1-10-8(12)4-6-11(2)15(13,14)7-3-5-9/h3-7,9H2,1-2H3,(H,10,12)
InChIKeyFQMTXVDMVRNNCO-UHFFFAOYSA-N
MW237.32 g/mol
LogP-1.27
Rot. Bonds7

About 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide

3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide (PubChem CID 106915137) has the molecular formula C8H19N3O3S and a molecular weight of 237.32 g/mol. Its IUPAC name is 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide.

Molecular Properties

Compound Name3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide
PubChem CID106915137
Molecular FormulaC8H19N3O3S
Molecular Weight237.32 g/mol
Exact Mass237.11
IUPAC Name3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide
SMILESCNC(=O)CCN(C)S(=O)(=O)CCCN
InChIInChI=1S/C8H19N3O3S/c1-10-8(12)4-6-11(2)15(13,14)7-3-5-9/h3-7,9H2,1-2H3,(H,10,12)
InChIKeyFQMTXVDMVRNNCO-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

Analyze 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide 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

3-[4-aminobutyl(methyl)amino]-N-methylpropanamide
CID 106914832
3-[2-aminoethyl(methyl)amino]-N-methylpropanamide
CID 58105370
2-[3-aminopropylsulfonyl(methyl)amino]-N,N-dimethylacetamide
CID 60910488
3-[[4-(2-aminoethyl)phenyl]sulfonyl-methylamino]-N-methylpropanamide
CID 106915105
3-[(2,4-dibromophenyl)sulfonyl-methylamino]-N-methylpropanamide
CID 103644791
2-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]-4-methylsulfonylbutanamide
CID 103827599
3-amino-N-methyl-N-(2-pyrrolidin-1-ylethyl)propane-1-sulfonamide
CID 63207731
3-[3-aminopropyl(2-methoxyethyl)amino]-N-methylpropanamide
CID 63287350
2-[4-aminobutyl(methyl)amino]-N-methylacetamide
CID 43374665
4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
CID 106813309
3-[(5-amino-4-fluoro-2-methylphenyl)sulfonyl-methylamino]-N-methylpropanamide
CID 106913988
3-amino-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propane-1-sulfonamide
CID 61442057

Frequently Asked Questions

What is the IUPAC name of 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide?
The IUPAC name of 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide (CID 106915137) is 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide.
What is the SMILES notation for 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide?
The canonical SMILES for 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide is CNC(=O)CCN(C)S(=O)(=O)CCCN.
What is the InChIKey of 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide?
The InChIKey is FQMTXVDMVRNNCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O3S/c1-10-8(12)4-6-11(2)15(13,14)7-3-5-9/h3-7,9H2,1-2H3,(H,10,12).
What are the key properties of 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide?
3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide 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 3-[3-aminopropylsulfonyl(methyl)amino]-N-methylpropanamide is sourced from PubChem (CID 106915137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).