(2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide

C8H16N2O4 — CID 135040049

IUPAC(2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide
SMILESC[C@H](O)C(=O)NCCNC(=O)[C@H](C)O
InChIInChI=1S/C8H16N2O4/c1-5(11)7(13)9-3-4-10-8(14)6(2)12/h5-6,11-12H,3-4H2,1-2H3,(H,9,13)(H,10,14)/t5-,6-/m0/s1
InChIKeyZUXOXRYPJYKLKK-WDSKDSINSA-N
MW204.23 g/mol
LogP-2.02
Rot. Bonds5

About (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide

(2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide (PubChem CID 135040049) has the molecular formula C8H16N2O4 and a molecular weight of 204.23 g/mol. Its IUPAC name is (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide
PubChem CID135040049
Molecular FormulaC8H16N2O4
Molecular Weight204.23 g/mol
Exact Mass204.11
IUPAC Name(2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide
SMILESC[C@H](O)C(=O)NCCNC(=O)[C@H](C)O
InChIInChI=1S/C8H16N2O4/c1-5(11)7(13)9-3-4-10-8(14)6(2)12/h5-6,11-12H,3-4H2,1-2H3,(H,9,13)(H,10,14)/t5-,6-/m0/s1
InChIKeyZUXOXRYPJYKLKK-WDSKDSINSA-N
XLogP-2.02
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 5-2.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]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-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide?
The IUPAC name of (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide (CID 135040049) is (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide.
What is the SMILES notation for (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide?
The canonical SMILES for (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide is C[C@H](O)C(=O)NCCNC(=O)[C@H](C)O.
What is the InChIKey of (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide?
The InChIKey is ZUXOXRYPJYKLKK-WDSKDSINSA-N. The full InChI is InChI=1S/C8H16N2O4/c1-5(11)7(13)9-3-4-10-8(14)6(2)12/h5-6,11-12H,3-4H2,1-2H3,(H,9,13)(H,10,14)/t5-,6-/m0/s1.
What are the key properties of (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide?
(2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide has a molecular weight of 204.23 g/mol, XLogP of -2.02, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-N-[2-[[(2S)-2-hydroxypropanoyl]amino]ethyl]propanamide is sourced from PubChem (CID 135040049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).