4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide

C8H14N2O3S2 — CID 61299191

IUPAC4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide
SMILESCOCCCNS(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C8H14N2O3S2/c1-13-4-2-3-10-15(11,12)8-5-7(9)6-14-8/h5-6,10H,2-4,9H2,1H3
InChIKeyCFPRFQMTAUCNJO-UHFFFAOYSA-N
MW250.34 g/mol
LogP0.65
Rot. Bonds6

About 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide

4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide (PubChem CID 61299191) has the molecular formula C8H14N2O3S2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide
PubChem CID61299191
Molecular FormulaC8H14N2O3S2
Molecular Weight250.34 g/mol
Exact Mass250.04
IUPAC Name4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide
SMILESCOCCCNS(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C8H14N2O3S2/c1-13-4-2-3-10-15(11,12)8-5-7(9)6-14-8/h5-6,10H,2-4,9H2,1H3
InChIKeyCFPRFQMTAUCNJO-UHFFFAOYSA-N
XLogP0.65
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide (CID 61299191) is 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide is COCCCNS(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide?
The InChIKey is CFPRFQMTAUCNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3S2/c1-13-4-2-3-10-15(11,12)8-5-7(9)6-14-8/h5-6,10H,2-4,9H2,1H3.
What are the key properties of 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide?
4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide has a molecular weight of 250.34 g/mol, XLogP of 0.65, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-methoxypropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 61299191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).