amino(diphenylphosphoryl)azanium

C12H14N2OP+ — CID 173419244

IUPACamino(diphenylphosphoryl)azanium
SMILESN[NH2+]P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H13N2OP/c13-14-16(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,13H2,(H,14,15)/p+1
InChIKeyNRACHDIQCDJEIP-UHFFFAOYSA-O
MW233.23 g/mol
LogP0.35
Rot. Bonds3

About amino(diphenylphosphoryl)azanium

amino(diphenylphosphoryl)azanium (PubChem CID 173419244) has the molecular formula C12H14N2OP+ and a molecular weight of 233.23 g/mol. Its IUPAC name is amino(diphenylphosphoryl)azanium.

Molecular Properties

Compound Nameamino(diphenylphosphoryl)azanium
PubChem CID173419244
Molecular FormulaC12H14N2OP+
Molecular Weight233.23 g/mol
Exact Mass233.08
IUPAC Nameamino(diphenylphosphoryl)azanium
SMILESN[NH2+]P(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H13N2OP/c13-14-16(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,13H2,(H,14,15)/p+1
InChIKeyNRACHDIQCDJEIP-UHFFFAOYSA-O
XLogP0.35
TPSA59.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

diphenylphosphorylbenzene;terbium
CID 86595283
phenylphosphonamidic acid
CID 18388605
1-[(1-amino-1-chloroethyl)-phenylphosphoryl]-1-chloroethanamine
CID 168876205
O-[aminooxy(phenyl)phosphoryl]hydroxylamine
CID 70403150
[[(1E,3E)-4-diphenylphosphorylbuta-1,3-dienyl]-phenylphosphoryl]benzene
CID 102152479
diphenylphosphorylazanide
CID 18705552
N-diphenylphosphorylcyclohepta-2,4,6-trien-1-imine
CID 15260741
phenylphosphonic acid;terbium
CID 175289814
phenylphosphonic acid;phosphane
CID 157219344
CID 66766975
CID 66766975
diphenylphosphinic acid chloride
CID 53401992
lithium diphenylphosphinate
CID 23680317

Frequently Asked Questions

What is the IUPAC name of amino(diphenylphosphoryl)azanium?
The IUPAC name of amino(diphenylphosphoryl)azanium (CID 173419244) is amino(diphenylphosphoryl)azanium.
What is the SMILES notation for amino(diphenylphosphoryl)azanium?
The canonical SMILES for amino(diphenylphosphoryl)azanium is N[NH2+]P(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of amino(diphenylphosphoryl)azanium?
The InChIKey is NRACHDIQCDJEIP-UHFFFAOYSA-O. The full InChI is InChI=1S/C12H13N2OP/c13-14-16(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,13H2,(H,14,15)/p+1.
What are the key properties of amino(diphenylphosphoryl)azanium?
amino(diphenylphosphoryl)azanium has a molecular weight of 233.23 g/mol, XLogP of 0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for amino(diphenylphosphoryl)azanium is sourced from PubChem (CID 173419244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).