dimethoxyphosphoryl 2-aminoacetate

C4H10NO5P — CID 150492348

IUPACdimethoxyphosphoryl 2-aminoacetate
SMILESCOP(=O)(OC)OC(=O)CN
InChIInChI=1S/C4H10NO5P/c1-8-11(7,9-2)10-4(6)3-5/h3,5H2,1-2H3
InChIKeyHWBDXUGCQLHANU-UHFFFAOYSA-N
MW183.10 g/mol
LogP-0.11
Rot. Bonds4

About dimethoxyphosphoryl 2-aminoacetate

dimethoxyphosphoryl 2-aminoacetate (PubChem CID 150492348) has the molecular formula C4H10NO5P and a molecular weight of 183.10 g/mol. Its IUPAC name is dimethoxyphosphoryl 2-aminoacetate.

Molecular Properties

Compound Namedimethoxyphosphoryl 2-aminoacetate
PubChem CID150492348
Molecular FormulaC4H10NO5P
Molecular Weight183.10 g/mol
Exact Mass183.03
IUPAC Namedimethoxyphosphoryl 2-aminoacetate
SMILESCOP(=O)(OC)OC(=O)CN
InChIInChI=1S/C4H10NO5P/c1-8-11(7,9-2)10-4(6)3-5/h3,5H2,1-2H3
InChIKeyHWBDXUGCQLHANU-UHFFFAOYSA-N
XLogP-0.11
TPSA87.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.10
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

potassium;hydride;methyl 2-aminoacetate
CID 175381316
calcium (2-aminoacetyl) phosphate
CID 170308225
dipotassium;(2-aminoacetyl) phosphate
CID 22483641
ethane-1,2-diol;methyl 2-aminoacetate
CID 122528539
dimethoxyphosphoryl 2-methylbutanoate
CID 174709594
[ethoxy(hydroxy)phosphoryl] 2-aminoacetate
CID 174702024
dimethoxyphosphoryl 2-phenoxyacetate
CID 151330688
di(propanoyloxy)phosphoryl propanoate
CID 23615441
methyl (E)-3-dimethoxyphosphoryloxybut-2-enoate
CID 5355863
potassium;hydride;phosphoric acid;trimethyl phosphate
CID 174889020
amino 2-aminoacetate;zinc
CID 87197519
2-(15N)azanylethanol;methane;methyl 2-(15N)azanylacetate;hydrochloride
CID 158378476

Frequently Asked Questions

What is the IUPAC name of dimethoxyphosphoryl 2-aminoacetate?
The IUPAC name of dimethoxyphosphoryl 2-aminoacetate (CID 150492348) is dimethoxyphosphoryl 2-aminoacetate.
What is the SMILES notation for dimethoxyphosphoryl 2-aminoacetate?
The canonical SMILES for dimethoxyphosphoryl 2-aminoacetate is COP(=O)(OC)OC(=O)CN.
What is the InChIKey of dimethoxyphosphoryl 2-aminoacetate?
The InChIKey is HWBDXUGCQLHANU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10NO5P/c1-8-11(7,9-2)10-4(6)3-5/h3,5H2,1-2H3.
What are the key properties of dimethoxyphosphoryl 2-aminoacetate?
dimethoxyphosphoryl 2-aminoacetate has a molecular weight of 183.10 g/mol, XLogP of -0.11, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxyphosphoryl 2-aminoacetate is sourced from PubChem (CID 150492348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).