8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde

C18H11ClN2O — CID 87886295

IUPAC8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1c(-c2ccc3ccccc3c2)nc2c(Cl)cccn12
InChIInChI=1S/C18H11ClN2O/c19-15-6-3-9-21-16(11-22)17(20-18(15)21)14-8-7-12-4-1-2-5-13(12)10-14/h1-11H
InChIKeyDCTFWQKJGURUJA-UHFFFAOYSA-N
MW306.75 g/mol
LogP4.62
Rot. Bonds2

About 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde

8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 87886295) has the molecular formula C18H11ClN2O and a molecular weight of 306.75 g/mol. Its IUPAC name is 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID87886295
Molecular FormulaC18H11ClN2O
Molecular Weight306.75 g/mol
Exact Mass306.06
IUPAC Name8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1c(-c2ccc3ccccc3c2)nc2c(Cl)cccn12
InChIInChI=1S/C18H11ClN2O/c19-15-6-3-9-21-16(11-22)17(20-18(15)21)14-8-7-12-4-1-2-5-13(12)10-14/h1-11H
InChIKeyDCTFWQKJGURUJA-UHFFFAOYSA-N
XLogP4.62
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 54.62
H-Bond Donors ≤ 50
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 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde (CID 87886295) is 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde is O=Cc1c(-c2ccc3ccccc3c2)nc2c(Cl)cccn12.
What is the InChIKey of 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is DCTFWQKJGURUJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClN2O/c19-15-6-3-9-21-16(11-22)17(20-18(15)21)14-8-7-12-4-1-2-5-13(12)10-14/h1-11H.
What are the key properties of 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde?
8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 306.75 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 87886295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).