N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide

C24H23N3O3 — CID 108788428

IUPACN-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
SMILESCOc1ccc(CCNC(=O)c2ccn3cc(-c4ccccc4)nc3c2)cc1OC
InChIInChI=1S/C24H23N3O3/c1-29-21-9-8-17(14-22(21)30-2)10-12-25-24(28)19-11-13-27-16-20(26-23(27)15-19)18-6-4-3-5-7-18/h3-9,11,13-16H,10,12H2,1-2H3,(H,25,28)
InChIKeyCNUCBRNYSJXABZ-UHFFFAOYSA-N
MW401.47 g/mol
LogP3.99
Rot. Bonds7

About N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide (PubChem CID 108788428) has the molecular formula C24H23N3O3 and a molecular weight of 401.47 g/mol. Its IUPAC name is N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
PubChem CID108788428
Molecular FormulaC24H23N3O3
Molecular Weight401.47 g/mol
Exact Mass401.17
IUPAC NameN-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
SMILESCOc1ccc(CCNC(=O)c2ccn3cc(-c4ccccc4)nc3c2)cc1OC
InChIInChI=1S/C24H23N3O3/c1-29-21-9-8-17(14-22(21)30-2)10-12-25-24(28)19-11-13-27-16-20(26-23(27)15-19)18-6-4-3-5-7-18/h3-9,11,13-16H,10,12H2,1-2H3,(H,25,28)
InChIKeyCNUCBRNYSJXABZ-UHFFFAOYSA-N
XLogP3.99
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-acetamidoethyl)-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
CID 108801482
2-phenyl-N-(3-propan-2-yloxypropyl)imidazo[1,2-a]pyridine-7-carboxamide
CID 108788516
N-[(4-carbamoylphenyl)methyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
CID 108801462
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-phenylimidazo[1,2-b]pyridazin-6-yl)sulfanylacetamide
CID 18573837
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-phenyltriazol-1-yl)acetamide
CID 166220873
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3-methylphenyl)-3-phenylpyrazole-5-carboxamide
CID 42758331
N-[2-[[N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-methylcarbamimidoyl]amino]ethyl]benzamide;hydroiodide
CID 111213306
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)imidazo[2,1-b][1,3]benzothiazole-6-carboxamide
CID 22523558
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenoxymethyl)benzamide
CID 26733446
2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzoic acid
CID 785993
4-(aminomethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide;hydrochloride
CID 119263813
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-phenylquinolin-4-yl)oxyacetamide
CID 46298653

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
The IUPAC name of N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide (CID 108788428) is N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
The canonical SMILES for N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide is COc1ccc(CCNC(=O)c2ccn3cc(-c4ccccc4)nc3c2)cc1OC.
What is the InChIKey of N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
The InChIKey is CNUCBRNYSJXABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O3/c1-29-21-9-8-17(14-22(21)30-2)10-12-25-24(28)19-11-13-27-16-20(26-23(27)15-19)18-6-4-3-5-7-18/h3-9,11,13-16H,10,12H2,1-2H3,(H,25,28).
What are the key properties of N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide has a molecular weight of 401.47 g/mol, XLogP of 3.99, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide is sourced from PubChem (CID 108788428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).