(2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid

C8H10N2O3 — CID 10986910

IUPAC(2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid
SMILESN[C@@H](Cc1ccc(O)cn1)C(=O)O
InChIInChI=1S/C8H10N2O3/c9-7(8(12)13)3-5-1-2-6(11)4-10-5/h1-2,4,7,11H,3,9H2,(H,12,13)/t7-/m0/s1
InChIKeyYOZSEGPJAXTSFZ-ZETCQYMHSA-N
MW182.18 g/mol
LogP-0.26
Rot. Bonds3

About (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid

(2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid (PubChem CID 10986910) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid.

Molecular Properties

Compound Name(2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid
PubChem CID10986910
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name(2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid
SMILESN[C@@H](Cc1ccc(O)cn1)C(=O)O
InChIInChI=1S/C8H10N2O3/c9-7(8(12)13)3-5-1-2-6(11)4-10-5/h1-2,4,7,11H,3,9H2,(H,12,13)/t7-/m0/s1
InChIKeyYOZSEGPJAXTSFZ-ZETCQYMHSA-N
XLogP-0.26
TPSA96.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)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

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid?
The IUPAC name of (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid (CID 10986910) is (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid.
What is the SMILES notation for (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid?
The canonical SMILES for (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid is N[C@@H](Cc1ccc(O)cn1)C(=O)O.
What is the InChIKey of (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid?
The InChIKey is YOZSEGPJAXTSFZ-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H10N2O3/c9-7(8(12)13)3-5-1-2-6(11)4-10-5/h1-2,4,7,11H,3,9H2,(H,12,13)/t7-/m0/s1.
What are the key properties of (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid?
(2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid has a molecular weight of 182.18 g/mol, XLogP of -0.26, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-(5-hydroxy-2-pyridinyl)propanoic acid is sourced from PubChem (CID 10986910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).