2-phenyl-1H-indole

C14H11N — CID 13698

IUPAC2-phenyl-1H-indole
SMILESc1ccc(-c2cc3ccccc3[nH]2)cc1
InChIInChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H
InChIKeyKLLLJCACIRKBDT-UHFFFAOYSA-N
MW193.25 g/mol
LogP3.83
Rot. Bonds1

About 2-phenyl-1H-indole

2-phenyl-1H-indole (PubChem CID 13698) has the molecular formula C14H11N and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-phenyl-1H-indole.

Molecular Properties

Compound Name2-phenyl-1H-indole
PubChem CID13698
Molecular FormulaC14H11N
Molecular Weight193.25 g/mol
Exact Mass193.09
IUPAC Name2-phenyl-1H-indole
SMILESc1ccc(-c2cc3ccccc3[nH]2)cc1
InChIInChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H
InChIKeyKLLLJCACIRKBDT-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 2-phenyl-1H-indole?
The IUPAC name of 2-phenyl-1H-indole (CID 13698) is 2-phenyl-1H-indole.
What is the SMILES notation for 2-phenyl-1H-indole?
The canonical SMILES for 2-phenyl-1H-indole is c1ccc(-c2cc3ccccc3[nH]2)cc1.
What is the InChIKey of 2-phenyl-1H-indole?
The InChIKey is KLLLJCACIRKBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H.
What are the key properties of 2-phenyl-1H-indole?
2-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 2-phenyl-1H-indole is sourced from PubChem (CID 13698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).