4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide

C9H16N2O3S2 — CID 81053665

IUPAC4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide
SMILESCCOCCN(C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C9H16N2O3S2/c1-3-14-5-4-11(2)16(12,13)9-6-8(10)7-15-9/h6-7H,3-5,10H2,1-2H3
InChIKeyNDZCYSJLGWUCJR-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.99
Rot. Bonds6

About 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide

4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide (PubChem CID 81053665) has the molecular formula C9H16N2O3S2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide
PubChem CID81053665
Molecular FormulaC9H16N2O3S2
Molecular Weight264.37 g/mol
Exact Mass264.06
IUPAC Name4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide
SMILESCCOCCN(C)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C9H16N2O3S2/c1-3-14-5-4-11(2)16(12,13)9-6-8(10)7-15-9/h6-7H,3-5,10H2,1-2H3
InChIKeyNDZCYSJLGWUCJR-UHFFFAOYSA-N
XLogP0.99
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-methyl-N-(2-methylsulfonylethyl)thiophene-2-sulfonamide
CID 79850156
4-amino-N-methyl-N-[2-(4-methylphenoxy)ethyl]thiophene-2-sulfonamide
CID 61300193
4-amino-N-methyl-N-(2-methylbutyl)thiophene-2-sulfonamide
CID 61300540
4-amino-2,6-dibromo-N-(2-ethoxyethyl)-N-methylbenzenesulfonamide
CID 81053036
4-amino-2,6-dichloro-N-(2-ethoxyethyl)-N-methylbenzenesulfonamide
CID 81052803
4-amino-N,N-bis(2-methoxyethyl)thiophene-2-sulfonamide
CID 61300165
4-amino-N-[(4-ethylphenyl)methyl]-N-methylthiophene-2-sulfonamide
CID 61299784
4-amino-N-(2-ethoxyethyl)-N,2-dimethylbenzenesulfonamide
CID 81053199
4-amino-N-methyl-N-(4-phenylbutyl)thiophene-2-sulfonamide
CID 61301532
4-amino-N,N-dibutylthiophene-2-sulfonamide
CID 61301508
2-amino-N-(2-ethoxyethyl)-N,4,5-trimethylbenzenesulfonamide
CID 81053826
2-[(4-aminothiophen-2-yl)sulfonyl-methylamino]-N-methylacetamide
CID 61301123

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide (CID 81053665) is 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide is CCOCCN(C)S(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide?
The InChIKey is NDZCYSJLGWUCJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3S2/c1-3-14-5-4-11(2)16(12,13)9-6-8(10)7-15-9/h6-7H,3-5,10H2,1-2H3.
What are the key properties of 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide?
4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide has a molecular weight of 264.37 g/mol, XLogP of 0.99, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-ethoxyethyl)-N-methylthiophene-2-sulfonamide is sourced from PubChem (CID 81053665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).