[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium

C13H13NO2PY- — CID 58152781

IUPAC[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium
SMILESCP(=[N-])(Oc1ccccc1)Oc1ccccc1.[Y]
InChIInChI=1S/C13H13NO2P.Y/c1-17(14,15-12-8-4-2-5-9-12)16-13-10-6-3-7-11-13;/h2-11H,1H3;/q-1;
InChIKeyXOVBMTTYFLGFTQ-UHFFFAOYSA-N
MW335.13 g/mol
LogP4.37
Rot. Bonds4

About [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium

[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium (PubChem CID 58152781) has the molecular formula C13H13NO2PY- and a molecular weight of 335.13 g/mol. Its IUPAC name is [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium.

Molecular Properties

Compound Name[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium
PubChem CID58152781
Molecular FormulaC13H13NO2PY-
Molecular Weight335.13 g/mol
Exact Mass334.97
IUPAC Name[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium
SMILESCP(=[N-])(Oc1ccccc1)Oc1ccccc1.[Y]
InChIInChI=1S/C13H13NO2P.Y/c1-17(14,15-12-8-4-2-5-9-12)16-13-10-6-3-7-11-13;/h2-11H,1H3;/q-1;
InChIKeyXOVBMTTYFLGFTQ-UHFFFAOYSA-N
XLogP4.37
TPSA40.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.13
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

triphenyl phosphate;hydrate
CID 66881958
bis(4-diphenoxyphosphoryloxyphenyl) phenyl phosphate
CID 58066863
2-methylpropane;triphenyl phosphate
CID 91193965
bis(2-methylphenyl) phenyl phosphate
CID 14618640
dimethyl phenyl phosphate;ethane;trimethyl phosphate
CID 90867053
diphenoxyphosphoryl diphenyl phosphate;propane
CID 162105616
phosphane;toluene;tris(4-methylphenyl) phosphate
CID 174780214
bis(ethenyl) phenyl phosphate
CID 22119346
[amino(methyl)phosphoryl]oxybenzene
CID 11864135
diphenyl silyl phosphate
CID 71371486
tris(4-phenoxyphenyl) phosphate
CID 70576220
CID 175741196
CID 175741196

Frequently Asked Questions

What is the IUPAC name of [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium?
The IUPAC name of [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium (CID 58152781) is [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium.
What is the SMILES notation for [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium?
The canonical SMILES for [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium is CP(=[N-])(Oc1ccccc1)Oc1ccccc1.[Y].
What is the InChIKey of [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium?
The InChIKey is XOVBMTTYFLGFTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2P.Y/c1-17(14,15-12-8-4-2-5-9-12)16-13-10-6-3-7-11-13;/h2-11H,1H3;/q-1;.
What are the key properties of [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium?
[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium has a molecular weight of 335.13 g/mol, XLogP of 4.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium is sourced from PubChem (CID 58152781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).