7,8-dihydropyrrolo[3,2-e]indole

C10H8N2 — CID 67793346

IUPAC7,8-dihydropyrrolo[3,2-e]indole
SMILESC1=Cc2c3c(ccc2=N1)=NCC3
InChIInChI=1S/C10H8N2/c1-2-10-8(4-6-12-10)7-3-5-11-9(1)7/h1-3,5H,4,6H2
InChIKeyUTJIZXXESXZYAJ-UHFFFAOYSA-N
MW156.19 g/mol
LogP0.47
Rot. Bonds

About 7,8-dihydropyrrolo[3,2-e]indole

7,8-dihydropyrrolo[3,2-e]indole (PubChem CID 67793346) has the molecular formula C10H8N2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 7,8-dihydropyrrolo[3,2-e]indole.

Molecular Properties

Compound Name7,8-dihydropyrrolo[3,2-e]indole
PubChem CID67793346
Molecular FormulaC10H8N2
Molecular Weight156.19 g/mol
Exact Mass156.07
IUPAC Name7,8-dihydropyrrolo[3,2-e]indole
SMILESC1=Cc2c3c(ccc2=N1)=NCC3
InChIInChI=1S/C10H8N2/c1-2-10-8(4-6-12-10)7-3-5-11-9(1)7/h1-3,5H,4,6H2
InChIKeyUTJIZXXESXZYAJ-UHFFFAOYSA-N
XLogP0.47
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7,8-dihydropyrrolo[3,2-e]indole?
The IUPAC name of 7,8-dihydropyrrolo[3,2-e]indole (CID 67793346) is 7,8-dihydropyrrolo[3,2-e]indole.
What is the SMILES notation for 7,8-dihydropyrrolo[3,2-e]indole?
The canonical SMILES for 7,8-dihydropyrrolo[3,2-e]indole is C1=Cc2c3c(ccc2=N1)=NCC3.
What is the InChIKey of 7,8-dihydropyrrolo[3,2-e]indole?
The InChIKey is UTJIZXXESXZYAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2/c1-2-10-8(4-6-12-10)7-3-5-11-9(1)7/h1-3,5H,4,6H2.
What are the key properties of 7,8-dihydropyrrolo[3,2-e]indole?
7,8-dihydropyrrolo[3,2-e]indole has a molecular weight of 156.19 g/mol, XLogP of 0.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydropyrrolo[3,2-e]indole is sourced from PubChem (CID 67793346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).