(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane

C5H13NO4Si — CID 131716757

IUPAC(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane
SMILESO=C(O)[C@@H]1C[C@@H](O)CN1.O[SiH3]
InChIInChI=1S/C5H9NO3.H4OSi/c7-3-1-4(5(8)9)6-2-3;1-2/h3-4,6-7H,1-2H2,(H,8,9);1H,2H3/t3-,4+;/m1./s1
InChIKeyXSXNHVZHUZDAHF-HJXLNUONSA-N
MW179.25 g/mol
LogP-2.95
Rot. Bonds1

About (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane

(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane (PubChem CID 131716757) has the molecular formula C5H13NO4Si and a molecular weight of 179.25 g/mol. Its IUPAC name is (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane.

Molecular Properties

Compound Name(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane
PubChem CID131716757
Molecular FormulaC5H13NO4Si
Molecular Weight179.25 g/mol
Exact Mass179.06
IUPAC Name(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane
SMILESO=C(O)[C@@H]1C[C@@H](O)CN1.O[SiH3]
InChIInChI=1S/C5H9NO3.H4OSi/c7-3-1-4(5(8)9)6-2-3;1-2/h3-4,6-7H,1-2H2,(H,8,9);1H,2H3/t3-,4+;/m1./s1
InChIKeyXSXNHVZHUZDAHF-HJXLNUONSA-N
XLogP-2.95
TPSA89.79 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.25
LogP ≤ 5-2.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane 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

(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydrochloride
CID 11205991
2-aminoacetic acid;(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid
CID 67068644
(2S,4S)-4-hydroxypyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid
CID 129315200
(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;1H-pyrrole
CID 172843797
(2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid
CID 157188043
2-[bis(2-hydroxyethyl)amino]ethanol;(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid
CID 174421816
4-hydroxypyrrolidine-2-carboxylic acid;2-(trimethylazaniumyl)acetate
CID 19098789
1-[(2S)-4-hydroxypyrrolidin-2-yl]ethanone
CID 154429079
2-aminoacetic acid;(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 66938353
copper bis((2S,4R)-4-hydroxypyrrolidine-2-carboxylate)
CID 25216296
(3S,5R)-5-hydroxydiazinane-3-carboxylic acid
CID 92557182
sodium (2S)-4-hydroxypyrrolidine-2-carboxylate
CID 141122108

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane?
The IUPAC name of (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane (CID 131716757) is (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane.
What is the SMILES notation for (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane?
The canonical SMILES for (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane is O=C(O)[C@@H]1C[C@@H](O)CN1.O[SiH3].
What is the InChIKey of (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane?
The InChIKey is XSXNHVZHUZDAHF-HJXLNUONSA-N. The full InChI is InChI=1S/C5H9NO3.H4OSi/c7-3-1-4(5(8)9)6-2-3;1-2/h3-4,6-7H,1-2H2,(H,8,9);1H,2H3/t3-,4+;/m1./s1.
What are the key properties of (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane?
(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane has a molecular weight of 179.25 g/mol, XLogP of -2.95, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane is sourced from PubChem (CID 131716757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).