8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C17H16IN3O2 — CID 110659980

IUPAC8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCOc1cccn2c(C(=O)Nc3ccc(I)cc3)c(C)nc12
InChIInChI=1S/C17H16IN3O2/c1-3-23-14-5-4-10-21-15(11(2)19-16(14)21)17(22)20-13-8-6-12(18)7-9-13/h4-10H,3H2,1-2H3,(H,20,22)
InChIKeyRWILHUFKQFTEKZ-UHFFFAOYSA-N
MW421.24 g/mol
LogP3.90
Rot. Bonds4

About 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide

8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 110659980) has the molecular formula C17H16IN3O2 and a molecular weight of 421.24 g/mol. Its IUPAC name is 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID110659980
Molecular FormulaC17H16IN3O2
Molecular Weight421.24 g/mol
Exact Mass421.03
IUPAC Name8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCOc1cccn2c(C(=O)Nc3ccc(I)cc3)c(C)nc12
InChIInChI=1S/C17H16IN3O2/c1-3-23-14-5-4-10-21-15(11(2)19-16(14)21)17(22)20-13-8-6-12(18)7-9-13/h4-10H,3H2,1-2H3,(H,20,22)
InChIKeyRWILHUFKQFTEKZ-UHFFFAOYSA-N
XLogP3.90
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.24
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

8-ethoxy-2-methyl-N-(4-pyrrolidin-1-ylphenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 110659994
8-ethoxy-2-methyl-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 110659989
8-ethoxy-N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90090266
8-ethoxy-2-methyl-N-[(3R,4S)-4-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane
CID 162253684
8-ethoxy-2-methyl-N-(2-phenoxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 90090368
(2S)-4-(8-ethoxy-2-methylimidazo[1,2-a]pyridin-3-yl)-4-oxo-2-phenylbutanoic acid
CID 147175818
4-[(8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 154474868
8-ethoxy-2-methyl-N-(3-pyridin-2-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 90090353
8-ethoxy-2-methyl-N-[(2S)-1-(2-methylphenyl)butan-2-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 163952937
8-ethoxy-2-methyl-N-(1-methylsulfonylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 90090260
N-(5-cyano-2,2-dimethyl-1,3-dioxan-5-yl)-8-ethoxy-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 147775711
2-(4-bromophenyl)-4-(8-ethoxy-2-methylimidazo[1,2-a]pyridin-3-yl)-4-oxobutanoic acid
CID 159230015

Frequently Asked Questions

What is the IUPAC name of 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 110659980) is 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide is CCOc1cccn2c(C(=O)Nc3ccc(I)cc3)c(C)nc12.
What is the InChIKey of 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is RWILHUFKQFTEKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16IN3O2/c1-3-23-14-5-4-10-21-15(11(2)19-16(14)21)17(22)20-13-8-6-12(18)7-9-13/h4-10H,3H2,1-2H3,(H,20,22).
What are the key properties of 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 421.24 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethoxy-N-(4-iodophenyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 110659980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).