pyrrolo[3,2-e]indole

C10H6N2 — CID 19433626

IUPACpyrrolo[3,2-e]indole
SMILESC1=Cc2c3c(ccc2=N1)=NC=C3
InChIInChI=1S/C10H6N2/c1-2-10-8(4-6-12-10)7-3-5-11-9(1)7/h1-6H
InChIKeyYLZWEPNHBVOIBC-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.89
Rot. Bonds

About pyrrolo[3,2-e]indole

pyrrolo[3,2-e]indole (PubChem CID 19433626) has the molecular formula C10H6N2 and a molecular weight of 154.17 g/mol. Its IUPAC name is pyrrolo[3,2-e]indole.

Molecular Properties

Compound Namepyrrolo[3,2-e]indole
PubChem CID19433626
Molecular FormulaC10H6N2
Molecular Weight154.17 g/mol
Exact Mass154.05
IUPAC Namepyrrolo[3,2-e]indole
SMILESC1=Cc2c3c(ccc2=N1)=NC=C3
InChIInChI=1S/C10H6N2/c1-2-10-8(4-6-12-10)7-3-5-11-9(1)7/h1-6H
InChIKeyYLZWEPNHBVOIBC-UHFFFAOYSA-N
XLogP0.89
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.89
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 pyrrolo[3,2-e]indole?
The IUPAC name of pyrrolo[3,2-e]indole (CID 19433626) is pyrrolo[3,2-e]indole.
What is the SMILES notation for pyrrolo[3,2-e]indole?
The canonical SMILES for pyrrolo[3,2-e]indole is C1=Cc2c3c(ccc2=N1)=NC=C3.
What is the InChIKey of pyrrolo[3,2-e]indole?
The InChIKey is YLZWEPNHBVOIBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N2/c1-2-10-8(4-6-12-10)7-3-5-11-9(1)7/h1-6H.
What are the key properties of pyrrolo[3,2-e]indole?
pyrrolo[3,2-e]indole has a molecular weight of 154.17 g/mol, XLogP of 0.89, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolo[3,2-e]indole is sourced from PubChem (CID 19433626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).