2-acetamidoethoxy-oxido-oxophosphanium

C4H8NO4P — CID 6372292

IUPAC2-acetamidoethoxy-oxido-oxophosphanium
SMILESCC(=O)NCCO[P+](=O)[O-]
InChIInChI=1S/C4H8NO4P/c1-4(6)5-2-3-9-10(7)8/h2-3H2,1H3,(H,5,6)
InChIKeyMVLHAFKVYVAGOV-UHFFFAOYSA-N
MW165.08 g/mol
LogP-0.84
Rot. Bonds4

About 2-acetamidoethoxy-oxido-oxophosphanium

2-acetamidoethoxy-oxido-oxophosphanium (PubChem CID 6372292) has the molecular formula C4H8NO4P and a molecular weight of 165.08 g/mol. Its IUPAC name is 2-acetamidoethoxy-oxido-oxophosphanium.

Molecular Properties

Compound Name2-acetamidoethoxy-oxido-oxophosphanium
PubChem CID6372292
Molecular FormulaC4H8NO4P
Molecular Weight165.08 g/mol
Exact Mass165.02
IUPAC Name2-acetamidoethoxy-oxido-oxophosphanium
SMILESCC(=O)NCCO[P+](=O)[O-]
InChIInChI=1S/C4H8NO4P/c1-4(6)5-2-3-9-10(7)8/h2-3H2,1H3,(H,5,6)
InChIKeyMVLHAFKVYVAGOV-UHFFFAOYSA-N
XLogP-0.84
TPSA78.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.08
LogP ≤ 5-0.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methylprop-2-enoylamino)ethoxy-oxido-oxophosphanium
CID 154599046
N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]acetamide
CID 18674787
2-acetamidoethyl hydrogen carbonate
CID 150133482
N-[2-(2-oxopropoxy)ethyl]acetamide
CID 144871697
N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
CID 54494115
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]acetamide
CID 87190698
2-acetamidoethyl propanoate
CID 54208768
N-(3-acetamidopropyl)acetamide
CID 5147555
2-acetamidoethyl propyl phosphate
CID 23558663
N-[2-(methylphosphanylmethoxy)ethyl]acetamide
CID 134365686
N-[2-(2-acetamidoethoxy)ethyl]-3-oxobutanamide
CID 91082226
2-acetamidoethyl iodomethyl carbonate
CID 11748163

Frequently Asked Questions

What is the IUPAC name of 2-acetamidoethoxy-oxido-oxophosphanium?
The IUPAC name of 2-acetamidoethoxy-oxido-oxophosphanium (CID 6372292) is 2-acetamidoethoxy-oxido-oxophosphanium.
What is the SMILES notation for 2-acetamidoethoxy-oxido-oxophosphanium?
The canonical SMILES for 2-acetamidoethoxy-oxido-oxophosphanium is CC(=O)NCCO[P+](=O)[O-].
What is the InChIKey of 2-acetamidoethoxy-oxido-oxophosphanium?
The InChIKey is MVLHAFKVYVAGOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8NO4P/c1-4(6)5-2-3-9-10(7)8/h2-3H2,1H3,(H,5,6).
What are the key properties of 2-acetamidoethoxy-oxido-oxophosphanium?
2-acetamidoethoxy-oxido-oxophosphanium has a molecular weight of 165.08 g/mol, XLogP of -0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamidoethoxy-oxido-oxophosphanium is sourced from PubChem (CID 6372292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).