1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole

C11H11N — CID 57101705

IUPAC1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole
SMILESC1=C2CNCC2c2ccccc21
InChIInChI=1S/C11H11N/c1-2-4-10-8(3-1)5-9-6-12-7-11(9)10/h1-5,11-12H,6-7H2
InChIKeyKPIAFOCHUMUYNS-UHFFFAOYSA-N
MW157.22 g/mol
LogP1.77
Rot. Bonds

About 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole

1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole (PubChem CID 57101705) has the molecular formula C11H11N and a molecular weight of 157.22 g/mol. Its IUPAC name is 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole.

Molecular Properties

Compound Name1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole
PubChem CID57101705
Molecular FormulaC11H11N
Molecular Weight157.22 g/mol
Exact Mass157.09
IUPAC Name1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole
SMILESC1=C2CNCC2c2ccccc21
InChIInChI=1S/C11H11N/c1-2-4-10-8(3-1)5-9-6-12-7-11(9)10/h1-5,11-12H,6-7H2
InChIKeyKPIAFOCHUMUYNS-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole?
The IUPAC name of 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole (CID 57101705) is 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole.
What is the SMILES notation for 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole?
The canonical SMILES for 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole is C1=C2CNCC2c2ccccc21.
What is the InChIKey of 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole?
The InChIKey is KPIAFOCHUMUYNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N/c1-2-4-10-8(3-1)5-9-6-12-7-11(9)10/h1-5,11-12H,6-7H2.
What are the key properties of 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole?
1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole has a molecular weight of 157.22 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,8b-tetrahydroindeno[1,2-c]pyrrole is sourced from PubChem (CID 57101705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).