[amino(phenyl)phosphoryl]benzene

C12H12NOP — CID 853560

IUPAC[amino(phenyl)phosphoryl]benzene
SMILESNP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H12NOP/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,13,14)
InChIKeyRIGIWEGXTTUCIQ-UHFFFAOYSA-N
MW217.21 g/mol
LogP1.87
Rot. Bonds2

About [amino(phenyl)phosphoryl]benzene

[amino(phenyl)phosphoryl]benzene (PubChem CID 853560) has the molecular formula C12H12NOP and a molecular weight of 217.21 g/mol. Its IUPAC name is [amino(phenyl)phosphoryl]benzene.

Molecular Properties

Compound Name[amino(phenyl)phosphoryl]benzene
PubChem CID853560
Molecular FormulaC12H12NOP
Molecular Weight217.21 g/mol
Exact Mass217.07
IUPAC Name[amino(phenyl)phosphoryl]benzene
SMILESNP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H12NOP/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,13,14)
InChIKeyRIGIWEGXTTUCIQ-UHFFFAOYSA-N
XLogP1.87
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.21
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [amino(phenyl)phosphoryl]benzene?
The IUPAC name of [amino(phenyl)phosphoryl]benzene (CID 853560) is [amino(phenyl)phosphoryl]benzene.
What is the SMILES notation for [amino(phenyl)phosphoryl]benzene?
The canonical SMILES for [amino(phenyl)phosphoryl]benzene is NP(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of [amino(phenyl)phosphoryl]benzene?
The InChIKey is RIGIWEGXTTUCIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12NOP/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,13,14).
What are the key properties of [amino(phenyl)phosphoryl]benzene?
[amino(phenyl)phosphoryl]benzene has a molecular weight of 217.21 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [amino(phenyl)phosphoryl]benzene is sourced from PubChem (CID 853560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).