8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one

C15H9NOS — CID 11736842

IUPAC8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one
SMILESO=C1c2cccc(-c3cccs3)c2-n2cccc21
InChIInChI=1S/C15H9NOS/c17-15-11-5-1-4-10(13-7-3-9-18-13)14(11)16-8-2-6-12(15)16/h1-9H
InChIKeyLXPOYZZPDPJAOP-UHFFFAOYSA-N
MW251.31 g/mol
LogP3.75
Rot. Bonds1

About 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one

8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one (PubChem CID 11736842) has the molecular formula C15H9NOS and a molecular weight of 251.31 g/mol. Its IUPAC name is 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one.

Molecular Properties

Compound Name8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one
PubChem CID11736842
Molecular FormulaC15H9NOS
Molecular Weight251.31 g/mol
Exact Mass251.04
IUPAC Name8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one
SMILESO=C1c2cccc(-c3cccs3)c2-n2cccc21
InChIInChI=1S/C15H9NOS/c17-15-11-5-1-4-10(13-7-3-9-18-13)14(11)16-8-2-6-12(15)16/h1-9H
InChIKeyLXPOYZZPDPJAOP-UHFFFAOYSA-N
XLogP3.75
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one?
The IUPAC name of 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one (CID 11736842) is 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one.
What is the SMILES notation for 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one?
The canonical SMILES for 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one is O=C1c2cccc(-c3cccs3)c2-n2cccc21.
What is the InChIKey of 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one?
The InChIKey is LXPOYZZPDPJAOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9NOS/c17-15-11-5-1-4-10(13-7-3-9-18-13)14(11)16-8-2-6-12(15)16/h1-9H.
What are the key properties of 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one?
8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one has a molecular weight of 251.31 g/mol, XLogP of 3.75, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-thiophen-2-ylpyrrolo[1,2-a]indol-4-one is sourced from PubChem (CID 11736842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).