N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide

C24H21N3O3 — CID 46943055

IUPACN-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide
SMILESCOc1cccc(-c2cc(NC(C)=O)c3ncc(-c4cccc(C(C)=O)c4)n3c2)c1
InChIInChI=1S/C24H21N3O3/c1-15(28)17-6-4-8-19(10-17)23-13-25-24-22(26-16(2)29)12-20(14-27(23)24)18-7-5-9-21(11-18)30-3/h4-14H,1-3H3,(H,26,29)
InChIKeyJKKQRHDWMSDGKL-UHFFFAOYSA-N
MW399.45 g/mol
LogP4.84
Rot. Bonds5

About N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide

N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide (PubChem CID 46943055) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide.

Molecular Properties

Compound NameN-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide
PubChem CID46943055
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC NameN-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide
SMILESCOc1cccc(-c2cc(NC(C)=O)c3ncc(-c4cccc(C(C)=O)c4)n3c2)c1
InChIInChI=1S/C24H21N3O3/c1-15(28)17-6-4-8-19(10-17)23-13-25-24-22(26-16(2)29)12-20(14-27(23)24)18-7-5-9-21(11-18)30-3/h4-14H,1-3H3,(H,26,29)
InChIKeyJKKQRHDWMSDGKL-UHFFFAOYSA-N
XLogP4.84
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide?
The IUPAC name of N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide (CID 46943055) is N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide.
What is the SMILES notation for N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide?
The canonical SMILES for N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide is COc1cccc(-c2cc(NC(C)=O)c3ncc(-c4cccc(C(C)=O)c4)n3c2)c1.
What is the InChIKey of N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide?
The InChIKey is JKKQRHDWMSDGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-15(28)17-6-4-8-19(10-17)23-13-25-24-22(26-16(2)29)12-20(14-27(23)24)18-7-5-9-21(11-18)30-3/h4-14H,1-3H3,(H,26,29).
What are the key properties of N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide?
N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide has a molecular weight of 399.45 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-acetylphenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]acetamide is sourced from PubChem (CID 46943055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).