5-benzylbenzo[b]phosphindole

C19H15P — CID 12575260

IUPAC5-benzylbenzo[b]phosphindole
SMILESc1ccc(Cp2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H15P/c1-2-8-15(9-3-1)14-20-18-12-6-4-10-16(18)17-11-5-7-13-19(17)20/h1-13H,14H2
InChIKeyFMJFWNZCPRLKTJ-UHFFFAOYSA-N
MW274.30 g/mol
LogP6.03
Rot. Bonds2

About 5-benzylbenzo[b]phosphindole

5-benzylbenzo[b]phosphindole (PubChem CID 12575260) has the molecular formula C19H15P and a molecular weight of 274.30 g/mol. Its IUPAC name is 5-benzylbenzo[b]phosphindole.

Molecular Properties

Compound Name5-benzylbenzo[b]phosphindole
PubChem CID12575260
Molecular FormulaC19H15P
Molecular Weight274.30 g/mol
Exact Mass274.09
IUPAC Name5-benzylbenzo[b]phosphindole
SMILESc1ccc(Cp2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H15P/c1-2-8-15(9-3-1)14-20-18-12-6-4-10-16(18)17-11-5-7-13-19(17)20/h1-13H,14H2
InChIKeyFMJFWNZCPRLKTJ-UHFFFAOYSA-N
XLogP6.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.30
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 5-benzylbenzo[b]phosphindole 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 5-benzylbenzo[b]phosphindole?
The IUPAC name of 5-benzylbenzo[b]phosphindole (CID 12575260) is 5-benzylbenzo[b]phosphindole.
What is the SMILES notation for 5-benzylbenzo[b]phosphindole?
The canonical SMILES for 5-benzylbenzo[b]phosphindole is c1ccc(Cp2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 5-benzylbenzo[b]phosphindole?
The InChIKey is FMJFWNZCPRLKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15P/c1-2-8-15(9-3-1)14-20-18-12-6-4-10-16(18)17-11-5-7-13-19(17)20/h1-13H,14H2.
What are the key properties of 5-benzylbenzo[b]phosphindole?
5-benzylbenzo[b]phosphindole has a molecular weight of 274.30 g/mol, XLogP of 6.03, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzylbenzo[b]phosphindole is sourced from PubChem (CID 12575260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).