2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde

C16H13ClN2O — CID 36688057

IUPAC2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1ccc2nc(-c3ccc(Cl)c(C)c3)c(C=O)n2c1
InChIInChI=1S/C16H13ClN2O/c1-10-3-6-15-18-16(14(9-20)19(15)8-10)12-4-5-13(17)11(2)7-12/h3-9H,1-2H3
InChIKeyMBEHCZXHJHPRKZ-UHFFFAOYSA-N
MW284.75 g/mol
LogP4.08
Rot. Bonds2

About 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde

2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 36688057) has the molecular formula C16H13ClN2O and a molecular weight of 284.75 g/mol. Its IUPAC name is 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID36688057
Molecular FormulaC16H13ClN2O
Molecular Weight284.75 g/mol
Exact Mass284.07
IUPAC Name2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1ccc2nc(-c3ccc(Cl)c(C)c3)c(C=O)n2c1
InChIInChI=1S/C16H13ClN2O/c1-10-3-6-15-18-16(14(9-20)19(15)8-10)12-4-5-13(17)11(2)7-12/h3-9H,1-2H3
InChIKeyMBEHCZXHJHPRKZ-UHFFFAOYSA-N
XLogP4.08
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.75
LogP ≤ 54.08
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-(2,4-dichlorophenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 36688047
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 36688055
ethyl 2-[6-(4-chloro-3-methylphenyl)-5-formylimidazo[2,1-b][1,3]thiazol-2-yl]acetate
CID 5190515
(E)-3-[2-(4-chloro-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]prop-2-enoic acid
CID 39195829
6-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82530278
6-(4-chloro-3-methylphenyl)-3-(furan-2-yl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 82036161
2-(4-chloro-3-methylphenyl)-7-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 93203858
3-(chloromethyl)-2-(4-chloro-3-methylphenyl)imidazo[1,2-a]pyridine
CID 39132933
2-(4-chloro-3-methylphenyl)indolizine-3-carbaldehyde
CID 4680448
3,6-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyridine;hydrobromide
CID 102552999
(E)-3-[6-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]prop-2-enoate
CID 7023742
2,6-dichloroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 14963394

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde (CID 36688057) is 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde is Cc1ccc2nc(-c3ccc(Cl)c(C)c3)c(C=O)n2c1.
What is the InChIKey of 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is MBEHCZXHJHPRKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O/c1-10-3-6-15-18-16(14(9-20)19(15)8-10)12-4-5-13(17)11(2)7-12/h3-9H,1-2H3.
What are the key properties of 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde?
2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 284.75 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-methylphenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 36688057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).