3-amino-N-(2-sulfamoylphenyl)propanamide

C9H13N3O3S — CID 10705385

IUPAC3-amino-N-(2-sulfamoylphenyl)propanamide
SMILESNCCC(=O)Nc1ccccc1S(N)(=O)=O
InChIInChI=1S/C9H13N3O3S/c10-6-5-9(13)12-7-3-1-2-4-8(7)16(11,14)15/h1-4H,5-6,10H2,(H,12,13)(H2,11,14,15)
InChIKeyLJJRQOXWQILZRF-UHFFFAOYSA-N
MW243.29 g/mol
LogP-0.38
Rot. Bonds4

About 3-amino-N-(2-sulfamoylphenyl)propanamide

3-amino-N-(2-sulfamoylphenyl)propanamide (PubChem CID 10705385) has the molecular formula C9H13N3O3S and a molecular weight of 243.29 g/mol. Its IUPAC name is 3-amino-N-(2-sulfamoylphenyl)propanamide.

Molecular Properties

Compound Name3-amino-N-(2-sulfamoylphenyl)propanamide
PubChem CID10705385
Molecular FormulaC9H13N3O3S
Molecular Weight243.29 g/mol
Exact Mass243.07
IUPAC Name3-amino-N-(2-sulfamoylphenyl)propanamide
SMILESNCCC(=O)Nc1ccccc1S(N)(=O)=O
InChIInChI=1S/C9H13N3O3S/c10-6-5-9(13)12-7-3-1-2-4-8(7)16(11,14)15/h1-4H,5-6,10H2,(H,12,13)(H2,11,14,15)
InChIKeyLJJRQOXWQILZRF-UHFFFAOYSA-N
XLogP-0.38
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 5-0.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-oxo-4-(2-sulfamoylanilino)butanoic acid
CID 61129519
3-(furan-2-yl)-N-(2-sulfamoylphenyl)propanamide
CID 61130146
2-phenylsulfanyl-N-(2-sulfamoylphenyl)acetamide
CID 78992086
2-cyclobutyl-N-(2-sulfamoylphenyl)acetamide
CID 103166193
N-(2-sulfamoylphenyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 61130907
3-methyl-5-oxo-5-(2-sulfamoylanilino)pentanoic acid
CID 62964751
N-(2-sulfamoylphenyl)-2-thiophen-3-ylacetamide
CID 61129954
N-[3-oxo-3-(2-sulfamoylanilino)propyl]-4-(2-sulfamoylphenyl)benzamide
CID 10207318
3-amino-N-(2-chlorophenyl)propanamide
CID 22692042
2-(3-aminopropanoylamino)benzamide
CID 22692052
3-amino-N-(2,3-dihydroxyphenyl)propanamide
CID 91188626
2-(cyclohexen-1-yl)-N-(2-sulfamoylphenyl)acetamide
CID 63563480

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-sulfamoylphenyl)propanamide?
The IUPAC name of 3-amino-N-(2-sulfamoylphenyl)propanamide (CID 10705385) is 3-amino-N-(2-sulfamoylphenyl)propanamide.
What is the SMILES notation for 3-amino-N-(2-sulfamoylphenyl)propanamide?
The canonical SMILES for 3-amino-N-(2-sulfamoylphenyl)propanamide is NCCC(=O)Nc1ccccc1S(N)(=O)=O.
What is the InChIKey of 3-amino-N-(2-sulfamoylphenyl)propanamide?
The InChIKey is LJJRQOXWQILZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3S/c10-6-5-9(13)12-7-3-1-2-4-8(7)16(11,14)15/h1-4H,5-6,10H2,(H,12,13)(H2,11,14,15).
What are the key properties of 3-amino-N-(2-sulfamoylphenyl)propanamide?
3-amino-N-(2-sulfamoylphenyl)propanamide has a molecular weight of 243.29 g/mol, XLogP of -0.38, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-sulfamoylphenyl)propanamide is sourced from PubChem (CID 10705385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).