5-phenyl-1H-indole

C14H11N — CID 11458210

IUPAC5-phenyl-1H-indole
SMILESc1ccc(-c2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C14H11N/c1-2-4-11(5-3-1)12-6-7-14-13(10-12)8-9-15-14/h1-10,15H
InChIKeyLPYXADUZSWBHCT-UHFFFAOYSA-N
MW193.25 g/mol
LogP3.83
Rot. Bonds1

About 5-phenyl-1H-indole

5-phenyl-1H-indole (PubChem CID 11458210) has the molecular formula C14H11N and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-phenyl-1H-indole.

Molecular Properties

Compound Name5-phenyl-1H-indole
PubChem CID11458210
Molecular FormulaC14H11N
Molecular Weight193.25 g/mol
Exact Mass193.09
IUPAC Name5-phenyl-1H-indole
SMILESc1ccc(-c2ccc3[nH]ccc3c2)cc1
InChIInChI=1S/C14H11N/c1-2-4-11(5-3-1)12-6-7-14-13(10-12)8-9-15-14/h1-10,15H
InChIKeyLPYXADUZSWBHCT-UHFFFAOYSA-N
XLogP3.83
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-1H-indole?
The IUPAC name of 5-phenyl-1H-indole (CID 11458210) is 5-phenyl-1H-indole.
What is the SMILES notation for 5-phenyl-1H-indole?
The canonical SMILES for 5-phenyl-1H-indole is c1ccc(-c2ccc3[nH]ccc3c2)cc1.
What is the InChIKey of 5-phenyl-1H-indole?
The InChIKey is LPYXADUZSWBHCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N/c1-2-4-11(5-3-1)12-6-7-14-13(10-12)8-9-15-14/h1-10,15H.
What are the key properties of 5-phenyl-1H-indole?
5-phenyl-1H-indole has a molecular weight of 193.25 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-1H-indole is sourced from PubChem (CID 11458210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).