8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde

C17H16N2O — CID 82529082

IUPAC8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1ccc(Cc2nc3c(C)cccn3c2C=O)cc1
InChIInChI=1S/C17H16N2O/c1-12-5-7-14(8-6-12)10-15-16(11-20)19-9-3-4-13(2)17(19)18-15/h3-9,11H,10H2,1-2H3
InChIKeyONFYTUSOXXPYOK-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.35
Rot. Bonds3

About 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde

8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 82529082) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID82529082
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1ccc(Cc2nc3c(C)cccn3c2C=O)cc1
InChIInChI=1S/C17H16N2O/c1-12-5-7-14(8-6-12)10-15-16(11-20)19-9-3-4-13(2)17(19)18-15/h3-9,11H,10H2,1-2H3
InChIKeyONFYTUSOXXPYOK-UHFFFAOYSA-N
XLogP3.35
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 82223219
2-[(4-ethylphenyl)methyl]-8-fluoroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529061
2,8-dimethylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 2758567
2-chloro-8-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529691
2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529103
6-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82530278
7-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529905
2-cyclopropyl-8-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 115405090
1-(2-benzyl-8-methylimidazo[1,2-a]pyridin-3-yl)-N,N-dimethylmethanamine
CID 82223087
2-[(4-ethylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82223320
1-[2-[(4-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
CID 94964221
2-(3,4-dimethoxyphenyl)-8-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 2758451

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde (CID 82529082) is 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde is Cc1ccc(Cc2nc3c(C)cccn3c2C=O)cc1.
What is the InChIKey of 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is ONFYTUSOXXPYOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12-5-7-14(8-6-12)10-15-16(11-20)19-9-3-4-13(2)17(19)18-15/h3-9,11H,10H2,1-2H3.
What are the key properties of 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde?
8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 264.33 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 82529082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).