(2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol

C5H14NO4P — CID 167170160

IUPAC(2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol
SMILESCOP(=O)(OC)C(N)[C@@H](C)O
InChIInChI=1S/C5H14NO4P/c1-4(7)5(6)11(8,9-2)10-3/h4-5,7H,6H2,1-3H3/t4-,5?/m1/s1
InChIKeyODKXFAQYLKFSCE-CNZKWPKMSA-N
MW183.14 g/mol
LogP0.14
Rot. Bonds4

About (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol

(2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol (PubChem CID 167170160) has the molecular formula C5H14NO4P and a molecular weight of 183.14 g/mol. Its IUPAC name is (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol
PubChem CID167170160
Molecular FormulaC5H14NO4P
Molecular Weight183.14 g/mol
Exact Mass183.07
IUPAC Name(2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol
SMILESCOP(=O)(OC)C(N)[C@@H](C)O
InChIInChI=1S/C5H14NO4P/c1-4(7)5(6)11(8,9-2)10-3/h4-5,7H,6H2,1-3H3/t4-,5?/m1/s1
InChIKeyODKXFAQYLKFSCE-CNZKWPKMSA-N
XLogP0.14
TPSA81.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.14
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol 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

1-dimethoxyphosphorylpropane-1,2-diol
CID 74820780
(1S,2S)-1-dimethoxyphosphorylpropane-1,2-diol
CID 42612314
methyl 2-dimethoxyphosphorylpropanoate
CID 11019771
methyl (2S)-2-dimethoxyphosphorylpropanoate
CID 124577703
1-bromo-1-dimethoxyphosphorylhexan-2-ol
CID 22399764
1-amino-1-dimethoxyphosphoryl-2-methylpropan-2-ol
CID 175019166
1-dimethoxyphosphoryl-3-methoxypropan-1-ol
CID 13339452
1-dimethoxyphosphorylprop-2-yn-1-ol
CID 130122610
(1R,2R)-1-dimethoxyphosphoryl-2-(4-methylphenyl)propan-1-ol
CID 72715863
ethyl 2-acetamido-2-dimethoxyphosphorylacetate
CID 66524865
2-[hydroperoxy(methoxy)phosphoryl]propanal
CID 175986894
(E)-1-dimethoxyphosphorylbut-2-en-1-ol
CID 5470785

Frequently Asked Questions

What is the IUPAC name of (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol?
The IUPAC name of (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol (CID 167170160) is (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol.
What is the SMILES notation for (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol?
The canonical SMILES for (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol is COP(=O)(OC)C(N)[C@@H](C)O.
What is the InChIKey of (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol?
The InChIKey is ODKXFAQYLKFSCE-CNZKWPKMSA-N. The full InChI is InChI=1S/C5H14NO4P/c1-4(7)5(6)11(8,9-2)10-3/h4-5,7H,6H2,1-3H3/t4-,5?/m1/s1.
What are the key properties of (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol?
(2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol has a molecular weight of 183.14 g/mol, XLogP of 0.14, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-amino-1-dimethoxyphosphorylpropan-2-ol is sourced from PubChem (CID 167170160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).