acetamidomethyl(hydroxy)phosphinate

C3H7NO4P- — CID 90659021

IUPACacetamidomethyl(hydroxy)phosphinate
SMILESCC(=O)NCP(=O)([O-])O
InChIInChI=1S/C3H8NO4P/c1-3(5)4-2-9(6,7)8/h2H2,1H3,(H,4,5)(H2,6,7,8)/p-1
InChIKeyFDNUAHPLMXZWLS-UHFFFAOYSA-M
MW152.07 g/mol
LogP-1.37
Rot. Bonds2

About acetamidomethyl(hydroxy)phosphinate

acetamidomethyl(hydroxy)phosphinate (PubChem CID 90659021) has the molecular formula C3H7NO4P- and a molecular weight of 152.07 g/mol. Its IUPAC name is acetamidomethyl(hydroxy)phosphinate.

Molecular Properties

Compound Nameacetamidomethyl(hydroxy)phosphinate
PubChem CID90659021
Molecular FormulaC3H7NO4P-
Molecular Weight152.07 g/mol
Exact Mass152.01
IUPAC Nameacetamidomethyl(hydroxy)phosphinate
SMILESCC(=O)NCP(=O)([O-])O
InChIInChI=1S/C3H8NO4P/c1-3(5)4-2-9(6,7)8/h2H2,1H3,(H,4,5)(H2,6,7,8)/p-1
InChIKeyFDNUAHPLMXZWLS-UHFFFAOYSA-M
XLogP-1.37
TPSA89.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.07
LogP ≤ 5-1.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of acetamidomethyl(hydroxy)phosphinate?
The IUPAC name of acetamidomethyl(hydroxy)phosphinate (CID 90659021) is acetamidomethyl(hydroxy)phosphinate.
What is the SMILES notation for acetamidomethyl(hydroxy)phosphinate?
The canonical SMILES for acetamidomethyl(hydroxy)phosphinate is CC(=O)NCP(=O)([O-])O.
What is the InChIKey of acetamidomethyl(hydroxy)phosphinate?
The InChIKey is FDNUAHPLMXZWLS-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H8NO4P/c1-3(5)4-2-9(6,7)8/h2H2,1H3,(H,4,5)(H2,6,7,8)/p-1.
What are the key properties of acetamidomethyl(hydroxy)phosphinate?
acetamidomethyl(hydroxy)phosphinate has a molecular weight of 152.07 g/mol, XLogP of -1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetamidomethyl(hydroxy)phosphinate is sourced from PubChem (CID 90659021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).