2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole

C17H14N2 — CID 57151255

IUPAC2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole
SMILESCC(C)(C1=NC2=CC=CC2=C1)C1=NC2=CC=CC2=C1
InChIInChI=1S/C17H14N2/c1-17(2,15-9-11-5-3-7-13(11)18-15)16-10-12-6-4-8-14(12)19-16/h3-10H,1-2H3
InChIKeyIJMIIKIFFWLXCM-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.68
Rot. Bonds2

About 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole

2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole (PubChem CID 57151255) has the molecular formula C17H14N2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole.

Molecular Properties

Compound Name2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole
PubChem CID57151255
Molecular FormulaC17H14N2
Molecular Weight246.31 g/mol
Exact Mass246.12
IUPAC Name2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole
SMILESCC(C)(C1=NC2=CC=CC2=C1)C1=NC2=CC=CC2=C1
InChIInChI=1S/C17H14N2/c1-17(2,15-9-11-5-3-7-13(11)18-15)16-10-12-6-4-8-14(12)19-16/h3-10H,1-2H3
InChIKeyIJMIIKIFFWLXCM-UHFFFAOYSA-N
XLogP3.68
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole?
The IUPAC name of 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole (CID 57151255) is 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole.
What is the SMILES notation for 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole?
The canonical SMILES for 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole is CC(C)(C1=NC2=CC=CC2=C1)C1=NC2=CC=CC2=C1.
What is the InChIKey of 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole?
The InChIKey is IJMIIKIFFWLXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2/c1-17(2,15-9-11-5-3-7-13(11)18-15)16-10-12-6-4-8-14(12)19-16/h3-10H,1-2H3.
What are the key properties of 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole?
2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole has a molecular weight of 246.31 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopenta[b]pyrrol-2-ylpropan-2-yl)cyclopenta[b]pyrrole is sourced from PubChem (CID 57151255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).