bis(1H-indol-2-yl)methanone

C17H12N2O — CID 10220822

IUPACbis(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H12N2O/c20-17(15-9-11-5-1-3-7-13(11)18-15)16-10-12-6-2-4-8-14(12)19-16/h1-10,18-19H
InChIKeyGQJIQKLWZMQQGO-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.88
Rot. Bonds2

About bis(1H-indol-2-yl)methanone

bis(1H-indol-2-yl)methanone (PubChem CID 10220822) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is bis(1H-indol-2-yl)methanone.

Molecular Properties

Compound Namebis(1H-indol-2-yl)methanone
PubChem CID10220822
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Namebis(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H12N2O/c20-17(15-9-11-5-1-3-7-13(11)18-15)16-10-12-6-2-4-8-14(12)19-16/h1-10,18-19H
InChIKeyGQJIQKLWZMQQGO-UHFFFAOYSA-N
XLogP3.88
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze bis(1H-indol-2-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(1H-indol-2-yl)methanone?
The IUPAC name of bis(1H-indol-2-yl)methanone (CID 10220822) is bis(1H-indol-2-yl)methanone.
What is the SMILES notation for bis(1H-indol-2-yl)methanone?
The canonical SMILES for bis(1H-indol-2-yl)methanone is O=C(c1cc2ccccc2[nH]1)c1cc2ccccc2[nH]1.
What is the InChIKey of bis(1H-indol-2-yl)methanone?
The InChIKey is GQJIQKLWZMQQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c20-17(15-9-11-5-1-3-7-13(11)18-15)16-10-12-6-2-4-8-14(12)19-16/h1-10,18-19H.
What are the key properties of bis(1H-indol-2-yl)methanone?
bis(1H-indol-2-yl)methanone has a molecular weight of 260.30 g/mol, XLogP of 3.88, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1H-indol-2-yl)methanone is sourced from PubChem (CID 10220822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).