2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde

C17H12N2O2 — CID 10754921

IUPAC2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde
SMILESO=Cc1ccc(/C=C/c2cn3cc(C=O)ccc3n2)cc1
InChIInChI=1S/C17H12N2O2/c20-11-14-3-1-13(2-4-14)5-7-16-10-19-9-15(12-21)6-8-17(19)18-16/h1-12H/b7-5+
InChIKeyMEYAXSHGKDDYLL-FNORWQNLSA-N
MW276.30 g/mol
LogP3.13
Rot. Bonds4

About 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde

2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde (PubChem CID 10754921) has the molecular formula C17H12N2O2 and a molecular weight of 276.30 g/mol. Its IUPAC name is 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde.

Molecular Properties

Compound Name2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde
PubChem CID10754921
Molecular FormulaC17H12N2O2
Molecular Weight276.30 g/mol
Exact Mass276.09
IUPAC Name2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde
SMILESO=Cc1ccc(/C=C/c2cn3cc(C=O)ccc3n2)cc1
InChIInChI=1S/C17H12N2O2/c20-11-14-3-1-13(2-4-14)5-7-16-10-19-9-15(12-21)6-8-17(19)18-16/h1-12H/b7-5+
InChIKeyMEYAXSHGKDDYLL-FNORWQNLSA-N
XLogP3.13
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[(E)-2-imidazo[1,2-a]pyridin-2-ylethenyl]benzaldehyde
CID 14042790
6-formylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 23155605
[1,2,4]triazolo[4,3-a]pyridine-6-carbaldehyde
CID 82417711
6-hydroxyimidazo[1,2-a]pyridine-2-carbaldehyde
CID 105431793
N'-propan-2-yl-2-[(E)-2-[4-(N'-propan-2-ylcarbamimidoyl)phenyl]ethenyl]imidazo[1,2-a]pyridine-6-carboximidamide
CID 11794661
2-(2-bromophenyl)imidazo[1,2-a]pyridine-6-carbaldehyde
CID 84739483
2-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-6-carbaldehyde
CID 117128929
(Z)-3-[4-[6-[(Z)-3-oxoprop-1-enyl]imidazo[1,2-a]pyridin-2-yl]phenyl]prop-2-enal
CID 99726261
2-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-6-carbaldehyde
CID 117130572
2-[(2-hydroxyphenyl)methyl]imidazo[1,2-a]pyridine-6-carbaldehyde
CID 117130452
tert-butyl N-[(6-formylimidazo[1,2-a]pyridin-2-yl)methyl]carbamate
CID 155167684
2-(5-methyl-1,3-thiazol-2-yl)imidazo[1,2-a]pyridine-6-carbaldehyde
CID 82386327

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde?
The IUPAC name of 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde (CID 10754921) is 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde.
What is the SMILES notation for 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde?
The canonical SMILES for 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde is O=Cc1ccc(/C=C/c2cn3cc(C=O)ccc3n2)cc1.
What is the InChIKey of 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde?
The InChIKey is MEYAXSHGKDDYLL-FNORWQNLSA-N. The full InChI is InChI=1S/C17H12N2O2/c20-11-14-3-1-13(2-4-14)5-7-16-10-19-9-15(12-21)6-8-17(19)18-16/h1-12H/b7-5+.
What are the key properties of 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde?
2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde has a molecular weight of 276.30 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(4-formylphenyl)ethenyl]imidazo[1,2-a]pyridine-6-carbaldehyde is sourced from PubChem (CID 10754921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).