2-amino-2-diphenylphosphanylacetic acid

C14H14NO2P — CID 146170624

IUPAC2-amino-2-diphenylphosphanylacetic acid
SMILESNC(C(=O)O)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H14NO2P/c15-13(14(16)17)18(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,15H2,(H,16,17)
InChIKeyRNPIJNLJQVKPFC-UHFFFAOYSA-N
MW259.25 g/mol
LogP1.49
Rot. Bonds4

About 2-amino-2-diphenylphosphanylacetic acid

2-amino-2-diphenylphosphanylacetic acid (PubChem CID 146170624) has the molecular formula C14H14NO2P and a molecular weight of 259.25 g/mol. Its IUPAC name is 2-amino-2-diphenylphosphanylacetic acid.

Molecular Properties

Compound Name2-amino-2-diphenylphosphanylacetic acid
PubChem CID146170624
Molecular FormulaC14H14NO2P
Molecular Weight259.25 g/mol
Exact Mass259.08
IUPAC Name2-amino-2-diphenylphosphanylacetic acid
SMILESNC(C(=O)O)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H14NO2P/c15-13(14(16)17)18(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,15H2,(H,16,17)
InChIKeyRNPIJNLJQVKPFC-UHFFFAOYSA-N
XLogP1.49
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.25
LogP ≤ 51.49
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

Acetic acid, (diphenylphosphinothioyl)-
CID 4179509
Carboxymethyldiphenylphosphine
CID 2773819
Diphenylboranyl 2-aminoacetate
CID 11840443
Diphenylphosphinoglycine
CID 69729690
2-[[Hydroxy(phenyl)phosphinothioyl]amino]acetic acid
CID 130397659
Triphenylphosphonioglycinate
CID 13429025
alpha-Triphenylphosphonioglycinate
CID 129837734
2-Diphenylphosphanylacetic acid;nickel monohydride
CID 134992142
2-(Diphenylphosphinothioylamino)acetic acid
CID 13241809
2-Aminoacetic acid;benzene
CID 23325133
2-Diphenylphosphinoselenoylacetic acid
CID 58764823
Methyl 2-(diphenylphosphorylamino)acetate;praseodymium
CID 59318212

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-diphenylphosphanylacetic acid?
The IUPAC name of 2-amino-2-diphenylphosphanylacetic acid (CID 146170624) is 2-amino-2-diphenylphosphanylacetic acid.
What is the SMILES notation for 2-amino-2-diphenylphosphanylacetic acid?
The canonical SMILES for 2-amino-2-diphenylphosphanylacetic acid is NC(C(=O)O)P(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-amino-2-diphenylphosphanylacetic acid?
The InChIKey is RNPIJNLJQVKPFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14NO2P/c15-13(14(16)17)18(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,15H2,(H,16,17).
What are the key properties of 2-amino-2-diphenylphosphanylacetic acid?
2-amino-2-diphenylphosphanylacetic acid has a molecular weight of 259.25 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-diphenylphosphanylacetic acid is sourced from PubChem (CID 146170624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).