(2S)-2-amino-4-(hydroxyamino)butanoic acid

C4H10N2O3 — CID 3082628

IUPAC(2S)-2-amino-4-(hydroxyamino)butanoic acid
SMILESN[C@@H](CCNO)C(=O)O
InChIInChI=1S/C4H10N2O3/c5-3(4(7)8)1-2-6-9/h3,6,9H,1-2,5H2,(H,7,8)/t3-/m0/s1
InChIKeyVIWSVOOCJXAYRE-VKHMYHEASA-N
MW134.14 g/mol
LogP-1.23
Rot. Bonds4

About (2S)-2-amino-4-(hydroxyamino)butanoic acid

(2S)-2-amino-4-(hydroxyamino)butanoic acid (PubChem CID 3082628) has the molecular formula C4H10N2O3 and a molecular weight of 134.14 g/mol. Its IUPAC name is (2S)-2-amino-4-(hydroxyamino)butanoic acid.

Molecular Properties

Compound Name(2S)-2-amino-4-(hydroxyamino)butanoic acid
PubChem CID3082628
Molecular FormulaC4H10N2O3
Molecular Weight134.14 g/mol
Exact Mass134.07
IUPAC Name(2S)-2-amino-4-(hydroxyamino)butanoic acid
SMILESN[C@@H](CCNO)C(=O)O
InChIInChI=1S/C4H10N2O3/c5-3(4(7)8)1-2-6-9/h3,6,9H,1-2,5H2,(H,7,8)/t3-/m0/s1
InChIKeyVIWSVOOCJXAYRE-VKHMYHEASA-N
XLogP-1.23
TPSA95.58 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 5-1.23
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-(hydroxyamino)butanoic acid?
The IUPAC name of (2S)-2-amino-4-(hydroxyamino)butanoic acid (CID 3082628) is (2S)-2-amino-4-(hydroxyamino)butanoic acid.
What is the SMILES notation for (2S)-2-amino-4-(hydroxyamino)butanoic acid?
The canonical SMILES for (2S)-2-amino-4-(hydroxyamino)butanoic acid is N[C@@H](CCNO)C(=O)O.
What is the InChIKey of (2S)-2-amino-4-(hydroxyamino)butanoic acid?
The InChIKey is VIWSVOOCJXAYRE-VKHMYHEASA-N. The full InChI is InChI=1S/C4H10N2O3/c5-3(4(7)8)1-2-6-9/h3,6,9H,1-2,5H2,(H,7,8)/t3-/m0/s1.
What are the key properties of (2S)-2-amino-4-(hydroxyamino)butanoic acid?
(2S)-2-amino-4-(hydroxyamino)butanoic acid has a molecular weight of 134.14 g/mol, XLogP of -1.23, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-4-(hydroxyamino)butanoic acid is sourced from PubChem (CID 3082628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).