(2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid

C9H16N2O5 — CID 80750308

IUPAC(2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid
SMILESCNC1COCC1C(=O)N[C@H](CO)C(=O)O
InChIInChI=1S/C9H16N2O5/c1-10-7-4-16-3-5(7)8(13)11-6(2-12)9(14)15/h5-7,10,12H,2-4H2,1H3,(H,11,13)(H,14,15)/t5?,6-,7?/m1/s1
InChIKeyWJUVBRQNZKZPIZ-YURFNIAASA-N
MW232.24 g/mol
LogP-2.22
Rot. Bonds5

About (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid

(2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid (PubChem CID 80750308) has the molecular formula C9H16N2O5 and a molecular weight of 232.24 g/mol. Its IUPAC name is (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid.

Molecular Properties

Compound Name(2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid
PubChem CID80750308
Molecular FormulaC9H16N2O5
Molecular Weight232.24 g/mol
Exact Mass232.11
IUPAC Name(2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid
SMILESCNC1COCC1C(=O)N[C@H](CO)C(=O)O
InChIInChI=1S/C9H16N2O5/c1-10-7-4-16-3-5(7)8(13)11-6(2-12)9(14)15/h5-7,10,12H,2-4H2,1H3,(H,11,13)(H,14,15)/t5?,6-,7?/m1/s1
InChIKeyWJUVBRQNZKZPIZ-YURFNIAASA-N
XLogP-2.22
TPSA107.89 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 5-2.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]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-amino-2-[[4-(methylamino)oxolane-3-carbonyl]amino]-4-oxobutanoic acid
CID 66264849
(2S)-3-hydroxy-2-[[4-(propylamino)oxolane-3-carbonyl]amino]propanoic acid
CID 66254627
N-(1-hydroxy-3-methylbutan-2-yl)-4-(methylamino)oxolane-3-carboxamide
CID 79249718
3,3-dimethyl-2-[[4-(methylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66266624
(2R)-2-[[4-(ethylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66258745
(2R)-2-[[4-(ethylamino)oxolane-3-carbonyl]amino]-4-hydroxybutanoic acid
CID 114005252
(2R)-3-hydroxy-2-[(2-methylcyclopropanecarbonyl)amino]propanoic acid
CID 80747756
2-[[4-(methylamino)oxolane-3-carbonyl]amino]-2-phenylacetic acid
CID 66267213
N-heptan-2-yl-4-(methylamino)oxolane-3-carboxamide
CID 66267744
(2S)-4-methoxy-4-oxo-2-[[4-(propylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66255034
4-amino-4-oxo-2-[[4-(propylamino)oxolane-3-carbonyl]amino]butanoic acid
CID 66254625
4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide
CID 66265448

Frequently Asked Questions

What is the IUPAC name of (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid?
The IUPAC name of (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid (CID 80750308) is (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid.
What is the SMILES notation for (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid?
The canonical SMILES for (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid is CNC1COCC1C(=O)N[C@H](CO)C(=O)O.
What is the InChIKey of (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid?
The InChIKey is WJUVBRQNZKZPIZ-YURFNIAASA-N. The full InChI is InChI=1S/C9H16N2O5/c1-10-7-4-16-3-5(7)8(13)11-6(2-12)9(14)15/h5-7,10,12H,2-4H2,1H3,(H,11,13)(H,14,15)/t5?,6-,7?/m1/s1.
What are the key properties of (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid?
(2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid has a molecular weight of 232.24 g/mol, XLogP of -2.22, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-hydroxy-2-[[4-(methylamino)oxolane-3-carbonyl]amino]propanoic acid is sourced from PubChem (CID 80750308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).