[(2R)-3-amino-2-fluoropropyl]phosphonic acid

C3H9FNO3P — CID 122184355

IUPAC[(2R)-3-amino-2-fluoropropyl]phosphonic acid
SMILESNC[C@@H](F)CP(=O)(O)O
InChIInChI=1S/C3H9FNO3P/c4-3(1-5)2-9(6,7)8/h3H,1-2,5H2,(H2,6,7,8)/t3-/m1/s1
InChIKeyRXCPDPLWAQULQX-GSVOUGTGSA-N
MW157.08 g/mol
LogP-0.54
Rot. Bonds3

About [(2R)-3-amino-2-fluoropropyl]phosphonic acid

[(2R)-3-amino-2-fluoropropyl]phosphonic acid (PubChem CID 122184355) has the molecular formula C3H9FNO3P and a molecular weight of 157.08 g/mol. Its IUPAC name is [(2R)-3-amino-2-fluoropropyl]phosphonic acid.

Molecular Properties

Compound Name[(2R)-3-amino-2-fluoropropyl]phosphonic acid
PubChem CID122184355
Molecular FormulaC3H9FNO3P
Molecular Weight157.08 g/mol
Exact Mass157.03
IUPAC Name[(2R)-3-amino-2-fluoropropyl]phosphonic acid
SMILESNC[C@@H](F)CP(=O)(O)O
InChIInChI=1S/C3H9FNO3P/c4-3(1-5)2-9(6,7)8/h3H,1-2,5H2,(H2,6,7,8)/t3-/m1/s1
InChIKeyRXCPDPLWAQULQX-GSVOUGTGSA-N
XLogP-0.54
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.08
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(2R)-3-amino-2-fluoropropyl]phosphonic acid?
The IUPAC name of [(2R)-3-amino-2-fluoropropyl]phosphonic acid (CID 122184355) is [(2R)-3-amino-2-fluoropropyl]phosphonic acid.
What is the SMILES notation for [(2R)-3-amino-2-fluoropropyl]phosphonic acid?
The canonical SMILES for [(2R)-3-amino-2-fluoropropyl]phosphonic acid is NC[C@@H](F)CP(=O)(O)O.
What is the InChIKey of [(2R)-3-amino-2-fluoropropyl]phosphonic acid?
The InChIKey is RXCPDPLWAQULQX-GSVOUGTGSA-N. The full InChI is InChI=1S/C3H9FNO3P/c4-3(1-5)2-9(6,7)8/h3H,1-2,5H2,(H2,6,7,8)/t3-/m1/s1.
What are the key properties of [(2R)-3-amino-2-fluoropropyl]phosphonic acid?
[(2R)-3-amino-2-fluoropropyl]phosphonic acid has a molecular weight of 157.08 g/mol, XLogP of -0.54, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-3-amino-2-fluoropropyl]phosphonic acid is sourced from PubChem (CID 122184355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).