ethoxy-N-methylphosphonamidic acid

C3H10NO3P — CID 20842965

IUPACethoxy-N-methylphosphonamidic acid
SMILESCCOP(=O)(O)NC
InChIInChI=1S/C3H10NO3P/c1-3-7-8(5,6)4-2/h3H2,1-2H3,(H2,4,5,6)
InChIKeyNQEUCALVQNPXMK-UHFFFAOYSA-N
MW139.09 g/mol
LogP0.34
Rot. Bonds3

About ethoxy-N-methylphosphonamidic acid

ethoxy-N-methylphosphonamidic acid (PubChem CID 20842965) has the molecular formula C3H10NO3P and a molecular weight of 139.09 g/mol. Its IUPAC name is ethoxy-N-methylphosphonamidic acid.

Molecular Properties

Compound Nameethoxy-N-methylphosphonamidic acid
PubChem CID20842965
Molecular FormulaC3H10NO3P
Molecular Weight139.09 g/mol
Exact Mass139.04
IUPAC Nameethoxy-N-methylphosphonamidic acid
SMILESCCOP(=O)(O)NC
InChIInChI=1S/C3H10NO3P/c1-3-7-8(5,6)4-2/h3H2,1-2H3,(H2,4,5,6)
InChIKeyNQEUCALVQNPXMK-UHFFFAOYSA-N
XLogP0.34
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.09
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl dihydrogen phosphate;N-methylmethanamine
CID 88518083
2-hydroxyethoxy-N-methylphosphonamidic acid
CID 123741981
ethoxy(methylaminomethyl)phosphinic acid
CID 88509213
ethoxy-N-methylphosphonamidic acid;(2E)-2-hydroxyimino-2-phenylacetonitrile
CID 20842988
alumane;tris(ethyl dihydrogen phosphate)
CID 173189565
copper;diethyl hydrogen phosphate
CID 174593393
diethyl hydrogen phosphate;phosphoric acid
CID 87753541
CID 54611578
CID 54611578
alumane;ethyl dihydrogen phosphate
CID 173113989
diethyl hydrogen phosphate;sulfane
CID 88774651
azane;bis(ethyl dihydrogen phosphate)
CID 174611775
diethyl hydrogen phosphate;scandium
CID 54607585

Frequently Asked Questions

What is the IUPAC name of ethoxy-N-methylphosphonamidic acid?
The IUPAC name of ethoxy-N-methylphosphonamidic acid (CID 20842965) is ethoxy-N-methylphosphonamidic acid.
What is the SMILES notation for ethoxy-N-methylphosphonamidic acid?
The canonical SMILES for ethoxy-N-methylphosphonamidic acid is CCOP(=O)(O)NC.
What is the InChIKey of ethoxy-N-methylphosphonamidic acid?
The InChIKey is NQEUCALVQNPXMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10NO3P/c1-3-7-8(5,6)4-2/h3H2,1-2H3,(H2,4,5,6).
What are the key properties of ethoxy-N-methylphosphonamidic acid?
ethoxy-N-methylphosphonamidic acid has a molecular weight of 139.09 g/mol, XLogP of 0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-N-methylphosphonamidic acid is sourced from PubChem (CID 20842965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).