7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole

C17H13N — CID 142658233

IUPAC7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole
SMILESc1ccc(-c2ccc3c(c2)-c2[nH]ccc2C3)cc1
InChIInChI=1S/C17H13N/c1-2-4-12(5-3-1)13-6-7-14-10-15-8-9-18-17(15)16(14)11-13/h1-9,11,18H,10H2
InChIKeyPNWRWFGTTDBSAY-UHFFFAOYSA-N
MW231.30 g/mol
LogP4.25
Rot. Bonds1

About 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole

7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole (PubChem CID 142658233) has the molecular formula C17H13N and a molecular weight of 231.30 g/mol. Its IUPAC name is 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole.

Molecular Properties

Compound Name7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole
PubChem CID142658233
Molecular FormulaC17H13N
Molecular Weight231.30 g/mol
Exact Mass231.10
IUPAC Name7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole
SMILESc1ccc(-c2ccc3c(c2)-c2[nH]ccc2C3)cc1
InChIInChI=1S/C17H13N/c1-2-4-12(5-3-1)13-6-7-14-10-15-8-9-18-17(15)16(14)11-13/h1-9,11,18H,10H2
InChIKeyPNWRWFGTTDBSAY-UHFFFAOYSA-N
XLogP4.25
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole?
The IUPAC name of 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole (CID 142658233) is 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole.
What is the SMILES notation for 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole?
The canonical SMILES for 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole is c1ccc(-c2ccc3c(c2)-c2[nH]ccc2C3)cc1.
What is the InChIKey of 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole?
The InChIKey is PNWRWFGTTDBSAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N/c1-2-4-12(5-3-1)13-6-7-14-10-15-8-9-18-17(15)16(14)11-13/h1-9,11,18H,10H2.
What are the key properties of 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole?
7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole has a molecular weight of 231.30 g/mol, XLogP of 4.25, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-1,4-dihydroindeno[1,2-b]pyrrole is sourced from PubChem (CID 142658233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).