3,5-diphenyltriazaphosphole

C13H10N3P — CID 14000517

IUPAC3,5-diphenyltriazaphosphole
SMILESc1ccc(-c2nnn(-c3ccccc3)p2)cc1
InChIInChI=1S/C13H10N3P/c1-3-7-11(8-4-1)13-14-15-16(17-13)12-9-5-2-6-10-12/h1-10H
InChIKeyNIGIMHQDHAWATP-UHFFFAOYSA-N
MW239.22 g/mol
LogP3.51
Rot. Bonds2

About 3,5-diphenyltriazaphosphole

3,5-diphenyltriazaphosphole (PubChem CID 14000517) has the molecular formula C13H10N3P and a molecular weight of 239.22 g/mol. Its IUPAC name is 3,5-diphenyltriazaphosphole.

Molecular Properties

Compound Name3,5-diphenyltriazaphosphole
PubChem CID14000517
Molecular FormulaC13H10N3P
Molecular Weight239.22 g/mol
Exact Mass239.06
IUPAC Name3,5-diphenyltriazaphosphole
SMILESc1ccc(-c2nnn(-c3ccccc3)p2)cc1
InChIInChI=1S/C13H10N3P/c1-3-7-11(8-4-1)13-14-15-16(17-13)12-9-5-2-6-10-12/h1-10H
InChIKeyNIGIMHQDHAWATP-UHFFFAOYSA-N
XLogP3.51
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.22
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,5-diphenyltriazaphosphole 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

2,5-Diphenyl-2H-tetrazole
CID 140328
2,5-Diphenyl-2H-1,2,4,3-triazaphosphole
CID 13719551
3-(4-Fluorophenyl)-5-phenyldithiadiazole 2-oxide
CID 142771212
3,5-Diphenyldithiadiazole 2-oxide
CID 142771214
Diphenylnitrilimine
CID 10878027
5-Tert-butyl-3-phenyltriazaphosphole
CID 10976954
2,5-Diphenyl-1,2,3-diazaarsole
CID 12489548
3-Benzyl-5-phenyltriazaphosphole
CID 14000514
2-Chloro-3,5-diphenyl-1,3,4,2-thiadiazaphosphole
CID 15761693
5-Benzyl-2-phenyl-2H-1,2,4,3-triazaphosphole
CID 71391893
3,5-Diphenyl-1,3,4,2-thiadiazaphosphol-3-ium;tetrachloroalumanuide
CID 134912483
4-Methyl-5-phenyl-2-(1-phenylprop-1-en-1-yl)-2h-1,2,3diazaphosphole
CID 156905651

Frequently Asked Questions

What is the IUPAC name of 3,5-diphenyltriazaphosphole?
The IUPAC name of 3,5-diphenyltriazaphosphole (CID 14000517) is 3,5-diphenyltriazaphosphole.
What is the SMILES notation for 3,5-diphenyltriazaphosphole?
The canonical SMILES for 3,5-diphenyltriazaphosphole is c1ccc(-c2nnn(-c3ccccc3)p2)cc1.
What is the InChIKey of 3,5-diphenyltriazaphosphole?
The InChIKey is NIGIMHQDHAWATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N3P/c1-3-7-11(8-4-1)13-14-15-16(17-13)12-9-5-2-6-10-12/h1-10H.
What are the key properties of 3,5-diphenyltriazaphosphole?
3,5-diphenyltriazaphosphole has a molecular weight of 239.22 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diphenyltriazaphosphole is sourced from PubChem (CID 14000517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).