phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate

C4H10NO3P — CID 174381323

IUPACphosphanyl (2S,3R)-2-amino-3-hydroxybutanoate
SMILESC[C@@H](O)[C@H](N)C(=O)OP
InChIInChI=1S/C4H10NO3P/c1-2(6)3(5)4(7)8-9/h2-3,6H,5,9H2,1H3/t2-,3+/m1/s1
InChIKeyPJBPRGSUNNCAAX-GBXIJSLDSA-N
MW151.10 g/mol
LogP-0.97
Rot. Bonds2

About phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate

phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate (PubChem CID 174381323) has the molecular formula C4H10NO3P and a molecular weight of 151.10 g/mol. Its IUPAC name is phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate.

Molecular Properties

Compound Namephosphanyl (2S,3R)-2-amino-3-hydroxybutanoate
PubChem CID174381323
Molecular FormulaC4H10NO3P
Molecular Weight151.10 g/mol
Exact Mass151.04
IUPAC Namephosphanyl (2S,3R)-2-amino-3-hydroxybutanoate
SMILESC[C@@H](O)[C@H](N)C(=O)OP
InChIInChI=1S/C4H10NO3P/c1-2(6)3(5)4(7)8-9/h2-3,6H,5,9H2,1H3/t2-,3+/m1/s1
InChIKeyPJBPRGSUNNCAAX-GBXIJSLDSA-N
XLogP-0.97
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.10
LogP ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S,3R)-2-amino-3-hydroxybutaneperoxoic acid
CID 87892301
propan-2-yl (2S,3S)-2-amino-3-hydroxybutanoate
CID 93251792
propan-2-yl (2R,3R)-2-amino-3-hydroxybutanoate;hydrochloride
CID 122539225
calcium;hydride;phosphanyl 2-hydroxypropanoate
CID 174498775
tert-butyl (2R,3S)-2-amino-3-hydroxybutanoate
CID 6941814
(2S,3R)-2-amino-3-hydroxybutanoic acid
CID 158974218
(2R,3S)-2-amino-3-hydroxybutanamide
CID 22877840
2-methoxyethyl 2-amino-3-hydroxybutanoate
CID 61279925
phosphono 2-amino-3-hydroxybutanoate
CID 23421193
(2S,3R)-2-amino-3-[(2S,3R)-2-amino-3-[(2S,3R)-2-amino-3-hydroxybutanoyl]oxybutanoyl]oxybutanoic acid
CID 87087959
2-amino-3-hydroxybutanoic acid;selane
CID 174980406
phosphanyl 2-bromopropanoate
CID 22086776

Frequently Asked Questions

What is the IUPAC name of phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate?
The IUPAC name of phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate (CID 174381323) is phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate.
What is the SMILES notation for phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate?
The canonical SMILES for phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate is C[C@@H](O)[C@H](N)C(=O)OP.
What is the InChIKey of phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate?
The InChIKey is PJBPRGSUNNCAAX-GBXIJSLDSA-N. The full InChI is InChI=1S/C4H10NO3P/c1-2(6)3(5)4(7)8-9/h2-3,6H,5,9H2,1H3/t2-,3+/m1/s1.
What are the key properties of phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate?
phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate has a molecular weight of 151.10 g/mol, XLogP of -0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phosphanyl (2S,3R)-2-amino-3-hydroxybutanoate is sourced from PubChem (CID 174381323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).