2-(pyridin-3-ylsulfonylamino)propanoic acid

C8H10N2O4S — CID 24691769

IUPAC2-(pyridin-3-ylsulfonylamino)propanoic acid
SMILESCC(NS(=O)(=O)c1cccnc1)C(=O)O
InChIInChI=1S/C8H10N2O4S/c1-6(8(11)12)10-15(13,14)7-3-2-4-9-5-7/h2-6,10H,1H3,(H,11,12)
InChIKeyFCRAROKJICKAAG-UHFFFAOYSA-N
MW230.25 g/mol
LogP-0.17
Rot. Bonds4

About 2-(pyridin-3-ylsulfonylamino)propanoic acid

2-(pyridin-3-ylsulfonylamino)propanoic acid (PubChem CID 24691769) has the molecular formula C8H10N2O4S and a molecular weight of 230.25 g/mol. Its IUPAC name is 2-(pyridin-3-ylsulfonylamino)propanoic acid.

Molecular Properties

Compound Name2-(pyridin-3-ylsulfonylamino)propanoic acid
PubChem CID24691769
Molecular FormulaC8H10N2O4S
Molecular Weight230.25 g/mol
Exact Mass230.04
IUPAC Name2-(pyridin-3-ylsulfonylamino)propanoic acid
SMILESCC(NS(=O)(=O)c1cccnc1)C(=O)O
InChIInChI=1S/C8H10N2O4S/c1-6(8(11)12)10-15(13,14)7-3-2-4-9-5-7/h2-6,10H,1H3,(H,11,12)
InChIKeyFCRAROKJICKAAG-UHFFFAOYSA-N
XLogP-0.17
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.25
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(pyridin-3-ylsulfonylamino)propanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-[(2S)-2-(pyridin-3-ylsulfonylamino)propanoyl]oxyphenyl] (2S)-2-(pyridin-3-ylsulfonylamino)propanoate
CID 142590055
N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
CID 79256160
N-(4-hydroxybutan-2-yl)pyridine-3-sulfonamide
CID 115477930
(2R)-2-(pyridin-3-ylsulfonylamino)pentanoic acid
CID 104935414
(2S)-2-[3-(pyridin-3-ylsulfonylamino)propanoylamino]propanoic acid
CID 119943288
(4-hydroxyphenyl) 2-(pyridin-3-ylsulfonylamino)propanoate
CID 166949920
N-(1-chloropropan-2-yl)pyridine-3-sulfonamide
CID 65030805
(2S)-2-hydroxy-3-(pyridin-3-ylsulfonylamino)propanoic acid
CID 104935920
(2S)-2-[(6-methylsulfonyl-3-pyridinyl)sulfonylamino]propanoic acid
CID 120660271
(2S)-2-[(6-methoxy-3-pyridinyl)sulfonylamino]propanoic acid
CID 122069805
(2R)-2-(isoquinolin-5-ylsulfonylamino)propanoic acid
CID 54991574
(2S)-2-(pyridin-3-ylamino)propanoic acid
CID 159663521

Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-3-ylsulfonylamino)propanoic acid?
The IUPAC name of 2-(pyridin-3-ylsulfonylamino)propanoic acid (CID 24691769) is 2-(pyridin-3-ylsulfonylamino)propanoic acid.
What is the SMILES notation for 2-(pyridin-3-ylsulfonylamino)propanoic acid?
The canonical SMILES for 2-(pyridin-3-ylsulfonylamino)propanoic acid is CC(NS(=O)(=O)c1cccnc1)C(=O)O.
What is the InChIKey of 2-(pyridin-3-ylsulfonylamino)propanoic acid?
The InChIKey is FCRAROKJICKAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O4S/c1-6(8(11)12)10-15(13,14)7-3-2-4-9-5-7/h2-6,10H,1H3,(H,11,12).
What are the key properties of 2-(pyridin-3-ylsulfonylamino)propanoic acid?
2-(pyridin-3-ylsulfonylamino)propanoic acid has a molecular weight of 230.25 g/mol, XLogP of -0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-3-ylsulfonylamino)propanoic acid is sourced from PubChem (CID 24691769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).