5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide

C8H14N2O3S2 — CID 43155671

IUPAC5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide
SMILESCOCCNS(=O)(=O)c1ccc(CN)s1
InChIInChI=1S/C8H14N2O3S2/c1-13-5-4-10-15(11,12)8-3-2-7(6-9)14-8/h2-3,10H,4-6,9H2,1H3
InChIKeyYBVWJXWFLCXKAW-UHFFFAOYSA-N
MW250.34 g/mol
LogP0.13
Rot. Bonds6

About 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide

5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide (PubChem CID 43155671) has the molecular formula C8H14N2O3S2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide
PubChem CID43155671
Molecular FormulaC8H14N2O3S2
Molecular Weight250.34 g/mol
Exact Mass250.04
IUPAC Name5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide
SMILESCOCCNS(=O)(=O)c1ccc(CN)s1
InChIInChI=1S/C8H14N2O3S2/c1-13-5-4-10-15(11,12)8-3-2-7(6-9)14-8/h2-3,10H,4-6,9H2,1H3
InChIKeyYBVWJXWFLCXKAW-UHFFFAOYSA-N
XLogP0.13
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 ≤ 50.13
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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Related Compounds

2-[5-(2-methoxyethylsulfamoyl)thiophen-2-yl]acetic acid
CID 29045889
N-[[5-(2-methoxyethylsulfamoyl)thiophen-2-yl]methyl]acetamide
CID 30180963
5-(aminomethyl)-N-[2-(dimethylamino)ethyl]thiophene-2-sulfonamide
CID 43155677
5-(aminomethyl)-N-[2-(cyclopropylmethoxy)ethyl]thiophene-2-sulfonamide
CID 114098349
5-(aminomethyl)-N-[(2-methoxyphenyl)methyl]thiophene-2-sulfonamide
CID 43332828
N-[2-[5-[2-(2-methoxyethylamino)ethylsulfamoyl]thiophen-2-yl]ethyl]acetamide
CID 120717361
5-(ethylaminomethyl)-N-(5-methoxypentyl)thiophene-2-sulfonamide
CID 106092710
N-[2-[5-[2-(2-methoxyethylamino)ethylsulfamoyl]thiophen-2-yl]ethyl]acetamide;hydrochloride
CID 120717360
5-ethyl-N-(2-propan-2-yloxyethyl)thiophene-2-sulfonamide
CID 110602852
5-(aminomethyl)-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]thiophene-2-sulfonamide
CID 80689627
2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-sulfonamide
CID 91812348
N-[2-(4-ethoxyphenoxy)ethyl]-5-ethylthiophene-2-sulfonamide
CID 30366253

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide (CID 43155671) is 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide is COCCNS(=O)(=O)c1ccc(CN)s1.
What is the InChIKey of 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide?
The InChIKey is YBVWJXWFLCXKAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3S2/c1-13-5-4-10-15(11,12)8-3-2-7(6-9)14-8/h2-3,10H,4-6,9H2,1H3.
What are the key properties of 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide?
5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide has a molecular weight of 250.34 g/mol, XLogP of 0.13, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(2-methoxyethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 43155671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).