2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide

C10H17N3O3S2 — CID 61299792

IUPAC2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide
SMILESCCCCN(CC(N)=O)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C10H17N3O3S2/c1-2-3-4-13(6-9(12)14)18(15,16)10-5-8(11)7-17-10/h5,7H,2-4,6,11H2,1H3,(H2,12,14)
InChIKeyZAAFDNYNBVZISY-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.61
Rot. Bonds7

About 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide

2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide (PubChem CID 61299792) has the molecular formula C10H17N3O3S2 and a molecular weight of 291.40 g/mol. Its IUPAC name is 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide.

Molecular Properties

Compound Name2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide
PubChem CID61299792
Molecular FormulaC10H17N3O3S2
Molecular Weight291.40 g/mol
Exact Mass291.07
IUPAC Name2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide
SMILESCCCCN(CC(N)=O)S(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C10H17N3O3S2/c1-2-3-4-13(6-9(12)14)18(15,16)10-5-8(11)7-17-10/h5,7H,2-4,6,11H2,1H3,(H2,12,14)
InChIKeyZAAFDNYNBVZISY-UHFFFAOYSA-N
XLogP0.61
TPSA106.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N,N-dibutylthiophene-2-sulfonamide
CID 61301508
2-[(3-amino-5-methylphenyl)sulfonyl-butylamino]acetamide
CID 61107191
2-[(5-amino-2,3-dimethylphenyl)sulfonyl-butylamino]acetamide
CID 61106635
4-amino-N-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
CID 61300939
2-[(3-amino-5-fluorophenyl)sulfonyl-butylamino]acetamide
CID 63322009
2-[butyl-(5-carbamothioylthiophen-2-yl)sulfonylamino]acetamide
CID 106270824
4-amino-N,N-bis(2-methoxyethyl)thiophene-2-sulfonamide
CID 61300165
2-[(2-amino-5-fluorophenyl)sulfonyl-butylamino]acetamide
CID 61105509
2-[(4-bromophenyl)sulfonyl-butylamino]acetamide
CID 47204425
2-[butyl-(2,5-dibromo-4-methylphenyl)sulfonylamino]acetamide
CID 80711575
2-[butyl-(2,4-dibromophenyl)sulfonylamino]acetamide
CID 47318380
2-[butyl-(3-sulfamoylphenyl)sulfonylamino]acetamide
CID 55702921

Frequently Asked Questions

What is the IUPAC name of 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide?
The IUPAC name of 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide (CID 61299792) is 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide.
What is the SMILES notation for 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide?
The canonical SMILES for 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide is CCCCN(CC(N)=O)S(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide?
The InChIKey is ZAAFDNYNBVZISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S2/c1-2-3-4-13(6-9(12)14)18(15,16)10-5-8(11)7-17-10/h5,7H,2-4,6,11H2,1H3,(H2,12,14).
What are the key properties of 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide?
2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide has a molecular weight of 291.40 g/mol, XLogP of 0.61, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-aminothiophen-2-yl)sulfonyl-butylamino]acetamide is sourced from PubChem (CID 61299792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).