N-[2-(methylamino)ethyl]thiophene-2-sulfonamide

C7H12N2O2S2 — CID 62658549

IUPACN-[2-(methylamino)ethyl]thiophene-2-sulfonamide
SMILESCNCCNS(=O)(=O)c1cccs1
InChIInChI=1S/C7H12N2O2S2/c1-8-4-5-9-13(10,11)7-3-2-6-12-7/h2-3,6,8-9H,4-5H2,1H3
InChIKeyZBLRSALDQQLOAW-UHFFFAOYSA-N
MW220.32 g/mol
LogP0.25
Rot. Bonds5

About N-[2-(methylamino)ethyl]thiophene-2-sulfonamide

N-[2-(methylamino)ethyl]thiophene-2-sulfonamide (PubChem CID 62658549) has the molecular formula C7H12N2O2S2 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-[2-(methylamino)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(methylamino)ethyl]thiophene-2-sulfonamide
PubChem CID62658549
Molecular FormulaC7H12N2O2S2
Molecular Weight220.32 g/mol
Exact Mass220.03
IUPAC NameN-[2-(methylamino)ethyl]thiophene-2-sulfonamide
SMILESCNCCNS(=O)(=O)c1cccs1
InChIInChI=1S/C7H12N2O2S2/c1-8-4-5-9-13(10,11)7-3-2-6-12-7/h2-3,6,8-9H,4-5H2,1H3
InChIKeyZBLRSALDQQLOAW-UHFFFAOYSA-N
XLogP0.25
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(ethylamino)ethyl]thiophene-2-sulfonamide;hydrochloride
CID 119973565
N-pentylthiophene-2-sulfonamide
CID 5150701
N-dodecylthiophene-2-sulfonamide
CID 19681497
N-[2-(2-methoxyethylamino)ethyl]thiophene-2-sulfonamide;hydrochloride
CID 120717968
N-(2-ethoxyethyl)thiophene-2-sulfonamide
CID 3855268
dimethyl-[3-(thiophen-2-ylsulfonylamino)propyl]azanium
CID 7765655
N-(3-aminopropyl)thiophene-2-sulfonamide;hydrochloride
CID 119962042
N-(2-aminooxyethyl)thiophene-2-sulfonamide
CID 39245279
N-[2-[methyl(propan-2-yl)amino]ethyl]thiophene-2-sulfonamide
CID 75511278
N-[2-(4-methylphenoxy)ethyl]thiophene-2-sulfonamide
CID 2998241
3-(thiophen-2-ylsulfonylamino)propanoate
CID 3420084
N-[3-(4-methoxyphenyl)propyl]thiophene-2-sulfonamide
CID 47330584

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-(methylamino)ethyl]thiophene-2-sulfonamide (CID 62658549) is N-[2-(methylamino)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-(methylamino)ethyl]thiophene-2-sulfonamide is CNCCNS(=O)(=O)c1cccs1.
What is the InChIKey of N-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
The InChIKey is ZBLRSALDQQLOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2S2/c1-8-4-5-9-13(10,11)7-3-2-6-12-7/h2-3,6,8-9H,4-5H2,1H3.
What are the key properties of N-[2-(methylamino)ethyl]thiophene-2-sulfonamide?
N-[2-(methylamino)ethyl]thiophene-2-sulfonamide has a molecular weight of 220.32 g/mol, XLogP of 0.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 62658549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).