propylphosphonamidic acid

C3H10NO2P — CID 22250964

IUPACpropylphosphonamidic acid
SMILESCCCP(N)(=O)O
InChIInChI=1S/C3H10NO2P/c1-2-3-7(4,5)6/h2-3H2,1H3,(H3,4,5,6)
InChIKeyCGGYPKNUINAAGP-UHFFFAOYSA-N
MW123.09 g/mol
LogP0.54
Rot. Bonds2

About propylphosphonamidic acid

propylphosphonamidic acid (PubChem CID 22250964) has the molecular formula C3H10NO2P and a molecular weight of 123.09 g/mol. Its IUPAC name is propylphosphonamidic acid.

Molecular Properties

Compound Namepropylphosphonamidic acid
PubChem CID22250964
Molecular FormulaC3H10NO2P
Molecular Weight123.09 g/mol
Exact Mass123.04
IUPAC Namepropylphosphonamidic acid
SMILESCCCP(N)(=O)O
InChIInChI=1S/C3H10NO2P/c1-2-3-7(4,5)6/h2-3H2,1H3,(H3,4,5,6)
InChIKeyCGGYPKNUINAAGP-UHFFFAOYSA-N
XLogP0.54
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.09
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methyl(propyl)phosphinic acid
CID 10992780
magnesium;dipropylphosphinic acid;hydride
CID 175497166
amino(ethylamino)phosphinic acid;hexane
CID 87856928
barium(2+);ethyl(propyl)phosphinic acid;hydride
CID 174823068
2-ethylbutylphosphonamidic acid
CID 22717998
alumane;butyl(propyl)phosphinic acid
CID 174987333
dimagnesium;dioxido-oxo-propyl-λ5-phosphane;dichloride
CID 153434042
dipropylphosphorylmethanol
CID 18981637
butane;methane;phosphoric acid;hydrate
CID 173079168
dihexylphosphinic acid;hexyl(propyl)phosphinic acid
CID 122574606
aminophosphonic acid;dodecan-1-ol
CID 174506019
butan-2-yl(propyl)phosphinic acid
CID 87395468

Frequently Asked Questions

What is the IUPAC name of propylphosphonamidic acid?
The IUPAC name of propylphosphonamidic acid (CID 22250964) is propylphosphonamidic acid.
What is the SMILES notation for propylphosphonamidic acid?
The canonical SMILES for propylphosphonamidic acid is CCCP(N)(=O)O.
What is the InChIKey of propylphosphonamidic acid?
The InChIKey is CGGYPKNUINAAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10NO2P/c1-2-3-7(4,5)6/h2-3H2,1H3,(H3,4,5,6).
What are the key properties of propylphosphonamidic acid?
propylphosphonamidic acid has a molecular weight of 123.09 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propylphosphonamidic acid is sourced from PubChem (CID 22250964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).