2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide

C10H16N4O3S — CID 103101163

IUPAC2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide
SMILESCCN(CC(N)=O)c1ccc(S(N)(=O)=O)c(N)c1
InChIInChI=1S/C10H16N4O3S/c1-2-14(6-10(12)15)7-3-4-9(8(11)5-7)18(13,16)17/h3-5H,2,6,11H2,1H3,(H2,12,15)(H2,13,16,17)
InChIKeyKVWLUUQGXVFOHW-UHFFFAOYSA-N
MW272.33 g/mol
LogP-0.77
Rot. Bonds5

About 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide

2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide (PubChem CID 103101163) has the molecular formula C10H16N4O3S and a molecular weight of 272.33 g/mol. Its IUPAC name is 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide.

Molecular Properties

Compound Name2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide
PubChem CID103101163
Molecular FormulaC10H16N4O3S
Molecular Weight272.33 g/mol
Exact Mass272.09
IUPAC Name2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide
SMILESCCN(CC(N)=O)c1ccc(S(N)(=O)=O)c(N)c1
InChIInChI=1S/C10H16N4O3S/c1-2-14(6-10(12)15)7-3-4-9(8(11)5-7)18(13,16)17/h3-5H,2,6,11H2,1H3,(H2,12,15)(H2,13,16,17)
InChIKeyKVWLUUQGXVFOHW-UHFFFAOYSA-N
XLogP-0.77
TPSA132.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 5-0.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-4-(diethylamino)benzenesulfonamide
CID 79460140
2-amino-4-[ethyl(propyl)amino]benzenesulfonamide
CID 79466974
2-amino-4-[benzyl(ethyl)amino]benzenesulfonamide
CID 79466847
2-(4-amino-N-ethyl-3-methylanilino)acetamide
CID 54103671
2-amino-4-[cyclobutylmethyl(ethyl)amino]benzenesulfonamide
CID 107397185
1-N,1-N-diethyl-4-methylsulfonylbenzene-1,3-diamine
CID 56831943
2-amino-4-[bis(2-methylpropyl)amino]benzenesulfonamide
CID 79466432
2-amino-4-(dimethylamino)benzenesulfonamide
CID 79466326
2-amino-4-[methyl(2,2,2-trifluoroethyl)amino]benzenesulfonamide
CID 79466601
2-[4-(aminomethyl)-N-ethylanilino]acetamide
CID 43275827
2-amino-4-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]benzenesulfonamide
CID 79466499
2-amino-4-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]benzoic acid
CID 104500358

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide?
The IUPAC name of 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide (CID 103101163) is 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide.
What is the SMILES notation for 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide?
The canonical SMILES for 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide is CCN(CC(N)=O)c1ccc(S(N)(=O)=O)c(N)c1.
What is the InChIKey of 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide?
The InChIKey is KVWLUUQGXVFOHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3S/c1-2-14(6-10(12)15)7-3-4-9(8(11)5-7)18(13,16)17/h3-5H,2,6,11H2,1H3,(H2,12,15)(H2,13,16,17).
What are the key properties of 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide?
2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide has a molecular weight of 272.33 g/mol, XLogP of -0.77, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-N-ethyl-4-sulfamoylanilino)acetamide is sourced from PubChem (CID 103101163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).