4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide

C10H19N3O2S2 — CID 55227522

IUPAC4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide
SMILESCN(C)CCCN(C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C10H19N3O2S2/c1-12(2)5-4-6-13(3)17(14,15)10-7-9(11)8-16-10/h7-8H,4-6,11H2,1-3H3
InChIKeyWSFZZFXZMOLABA-UHFFFAOYSA-N
MW277.41 g/mol
LogP0.90
Rot. Bonds6

About 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide

4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide (PubChem CID 55227522) has the molecular formula C10H19N3O2S2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide
PubChem CID55227522
Molecular FormulaC10H19N3O2S2
Molecular Weight277.41 g/mol
Exact Mass277.09
IUPAC Name4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide
SMILESCN(C)CCCN(C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C10H19N3O2S2/c1-12(2)5-4-6-13(3)17(14,15)10-7-9(11)8-16-10/h7-8H,4-6,11H2,1-3H3
InChIKeyWSFZZFXZMOLABA-UHFFFAOYSA-N
XLogP0.90
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide (CID 55227522) is 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide is CN(C)CCCN(C)S(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide?
The InChIKey is WSFZZFXZMOLABA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2S2/c1-12(2)5-4-6-13(3)17(14,15)10-7-9(11)8-16-10/h7-8H,4-6,11H2,1-3H3.
What are the key properties of 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide?
4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide has a molecular weight of 277.41 g/mol, XLogP of 0.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[3-(dimethylamino)propyl]-N-methylthiophene-2-sulfonamide is sourced from PubChem (CID 55227522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).