(2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide

C5H11N3O3 — CID 10329576

IUPAC(2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide
SMILESC[C@H](N)C(=O)NCC(=O)NO
InChIInChI=1S/C5H11N3O3/c1-3(6)5(10)7-2-4(9)8-11/h3,11H,2,6H2,1H3,(H,7,10)(H,8,9)/t3-/m0/s1
InChIKeyUTJQATZTFMUMNT-VKHMYHEASA-N
MW161.16 g/mol
LogP-2.04
Rot. Bonds3

About (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide

(2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide (PubChem CID 10329576) has the molecular formula C5H11N3O3 and a molecular weight of 161.16 g/mol. Its IUPAC name is (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide
PubChem CID10329576
Molecular FormulaC5H11N3O3
Molecular Weight161.16 g/mol
Exact Mass161.08
IUPAC Name(2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide
SMILESC[C@H](N)C(=O)NCC(=O)NO
InChIInChI=1S/C5H11N3O3/c1-3(6)5(10)7-2-4(9)8-11/h3,11H,2,6H2,1H3,(H,7,10)(H,8,9)/t3-/m0/s1
InChIKeyUTJQATZTFMUMNT-VKHMYHEASA-N
XLogP-2.04
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 5-2.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide 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-N-[2-(hydroxyamino)-2-oxoethyl]propanamide?
The IUPAC name of (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide (CID 10329576) is (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide.
What is the SMILES notation for (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide?
The canonical SMILES for (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide is C[C@H](N)C(=O)NCC(=O)NO.
What is the InChIKey of (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide?
The InChIKey is UTJQATZTFMUMNT-VKHMYHEASA-N. The full InChI is InChI=1S/C5H11N3O3/c1-3(6)5(10)7-2-4(9)8-11/h3,11H,2,6H2,1H3,(H,7,10)(H,8,9)/t3-/m0/s1.
What are the key properties of (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide?
(2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide has a molecular weight of 161.16 g/mol, XLogP of -2.04, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[2-(hydroxyamino)-2-oxoethyl]propanamide is sourced from PubChem (CID 10329576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).