[(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid

C4H10NO4P — CID 58696781

IUPAC[(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid
SMILESCC/C(=N/O)P(=O)(O)OC
InChIInChI=1S/C4H10NO4P/c1-3-4(5-6)10(7,8)9-2/h6H,3H2,1-2H3,(H,7,8)/b5-4-
InChIKeyULSWRWLDPVHXTE-PLNGDYQASA-N
MW167.10 g/mol
LogP1.02
Rot. Bonds3

About [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid

[(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid (PubChem CID 58696781) has the molecular formula C4H10NO4P and a molecular weight of 167.10 g/mol. Its IUPAC name is [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid.

Molecular Properties

Compound Name[(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid
PubChem CID58696781
Molecular FormulaC4H10NO4P
Molecular Weight167.10 g/mol
Exact Mass167.03
IUPAC Name[(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid
SMILESCC/C(=N/O)P(=O)(O)OC
InChIInChI=1S/C4H10NO4P/c1-3-4(5-6)10(7,8)9-2/h6H,3H2,1-2H3,(H,7,8)/b5-4-
InChIKeyULSWRWLDPVHXTE-PLNGDYQASA-N
XLogP1.02
TPSA79.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.10
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid?
The IUPAC name of [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid (CID 58696781) is [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid.
What is the SMILES notation for [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid?
The canonical SMILES for [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid is CC/C(=N/O)P(=O)(O)OC.
What is the InChIKey of [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid?
The InChIKey is ULSWRWLDPVHXTE-PLNGDYQASA-N. The full InChI is InChI=1S/C4H10NO4P/c1-3-4(5-6)10(7,8)9-2/h6H,3H2,1-2H3,(H,7,8)/b5-4-.
What are the key properties of [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid?
[(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid has a molecular weight of 167.10 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-C-ethyl-N-hydroxycarbonimidoyl]-methoxyphosphinic acid is sourced from PubChem (CID 58696781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).