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

C9H17N3O2S2 — CID 61300006

IUPAC4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide
SMILESCC(CNS(=O)(=O)c1cc(N)cs1)N(C)C
InChIInChI=1S/C9H17N3O2S2/c1-7(12(2)3)5-11-16(13,14)9-4-8(10)6-15-9/h4,6-7,11H,5,10H2,1-3H3
InChIKeyXMFSFSOHORMCQH-UHFFFAOYSA-N
MW263.39 g/mol
LogP0.56
Rot. Bonds5

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

4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide (PubChem CID 61300006) has the molecular formula C9H17N3O2S2 and a molecular weight of 263.39 g/mol. Its IUPAC name is 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide
PubChem CID61300006
Molecular FormulaC9H17N3O2S2
Molecular Weight263.39 g/mol
Exact Mass263.08
IUPAC Name4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide
SMILESCC(CNS(=O)(=O)c1cc(N)cs1)N(C)C
InChIInChI=1S/C9H17N3O2S2/c1-7(12(2)3)5-11-16(13,14)9-4-8(10)6-15-9/h4,6-7,11H,5,10H2,1-3H3
InChIKeyXMFSFSOHORMCQH-UHFFFAOYSA-N
XLogP0.56
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide (CID 61300006) is 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide is CC(CNS(=O)(=O)c1cc(N)cs1)N(C)C.
What is the InChIKey of 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide?
The InChIKey is XMFSFSOHORMCQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2S2/c1-7(12(2)3)5-11-16(13,14)9-4-8(10)6-15-9/h4,6-7,11H,5,10H2,1-3H3.
What are the key properties of 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide?
4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide has a molecular weight of 263.39 g/mol, XLogP of 0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(dimethylamino)propyl]thiophene-2-sulfonamide is sourced from PubChem (CID 61300006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).