diphenylphosphane;1H-imidazole

C15H15N2P — CID 158285047

IUPACdiphenylphosphane;1H-imidazole
SMILESc1c[nH]cn1.c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.C3H4N2/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-5-3-4-1/h1-10,13H;1-3H,(H,4,5)
InChIKeyGKRGPUXTNPCXIP-UHFFFAOYSA-N
MW254.27 g/mol
LogP2.73
Rot. Bonds2

About diphenylphosphane;1H-imidazole

diphenylphosphane;1H-imidazole (PubChem CID 158285047) has the molecular formula C15H15N2P and a molecular weight of 254.27 g/mol. Its IUPAC name is diphenylphosphane;1H-imidazole.

Molecular Properties

Compound Namediphenylphosphane;1H-imidazole
PubChem CID158285047
Molecular FormulaC15H15N2P
Molecular Weight254.27 g/mol
Exact Mass254.10
IUPAC Namediphenylphosphane;1H-imidazole
SMILESc1c[nH]cn1.c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.C3H4N2/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-5-3-4-1/h1-10,13H;1-3H,(H,4,5)
InChIKeyGKRGPUXTNPCXIP-UHFFFAOYSA-N
XLogP2.73
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze diphenylphosphane;1H-imidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of diphenylphosphane;1H-imidazole?
The IUPAC name of diphenylphosphane;1H-imidazole (CID 158285047) is diphenylphosphane;1H-imidazole.
What is the SMILES notation for diphenylphosphane;1H-imidazole?
The canonical SMILES for diphenylphosphane;1H-imidazole is c1c[nH]cn1.c1ccc(Pc2ccccc2)cc1.
What is the InChIKey of diphenylphosphane;1H-imidazole?
The InChIKey is GKRGPUXTNPCXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11P.C3H4N2/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-5-3-4-1/h1-10,13H;1-3H,(H,4,5).
What are the key properties of diphenylphosphane;1H-imidazole?
diphenylphosphane;1H-imidazole has a molecular weight of 254.27 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphane;1H-imidazole is sourced from PubChem (CID 158285047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).