6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde

C16H11N3O — CID 86670612

IUPAC6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1cnc2ccc(-c3cc4ccccc4[nH]3)cn12
InChIInChI=1S/C16H11N3O/c20-10-13-8-17-16-6-5-12(9-19(13)16)15-7-11-3-1-2-4-14(11)18-15/h1-10,18H
InChIKeyVZNRVTVGSYNTFL-UHFFFAOYSA-N
MW261.28 g/mol
LogP3.30
Rot. Bonds2

About 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde

6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 86670612) has the molecular formula C16H11N3O and a molecular weight of 261.28 g/mol. Its IUPAC name is 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID86670612
Molecular FormulaC16H11N3O
Molecular Weight261.28 g/mol
Exact Mass261.09
IUPAC Name6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1cnc2ccc(-c3cc4ccccc4[nH]3)cn12
InChIInChI=1S/C16H11N3O/c20-10-13-8-17-16-6-5-12(9-19(13)16)15-7-11-3-1-2-4-14(11)18-15/h1-10,18H
InChIKeyVZNRVTVGSYNTFL-UHFFFAOYSA-N
XLogP3.30
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde (CID 86670612) is 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde is O=Cc1cnc2ccc(-c3cc4ccccc4[nH]3)cn12.
What is the InChIKey of 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is VZNRVTVGSYNTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3O/c20-10-13-8-17-16-6-5-12(9-19(13)16)15-7-11-3-1-2-4-14(11)18-15/h1-10,18H.
What are the key properties of 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 261.28 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-indol-2-yl)imidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 86670612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).