1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone

C22H22N4O — CID 11268346

IUPAC1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone
SMILESCc1ccc(-c2nc3ccc(C)cn3c2CC(=O)c2cc(C)nn2C)cc1
InChIInChI=1S/C22H22N4O/c1-14-5-8-17(9-6-14)22-19(26-13-15(2)7-10-21(26)23-22)12-20(27)18-11-16(3)24-25(18)4/h5-11,13H,12H2,1-4H3
InChIKeyRRSWPILKRQBBAT-UHFFFAOYSA-N
MW358.45 g/mol
LogP4.09
Rot. Bonds4

About 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone

1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone (PubChem CID 11268346) has the molecular formula C22H22N4O and a molecular weight of 358.45 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone
PubChem CID11268346
Molecular FormulaC22H22N4O
Molecular Weight358.45 g/mol
Exact Mass358.18
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone
SMILESCc1ccc(-c2nc3ccc(C)cn3c2CC(=O)c2cc(C)nn2C)cc1
InChIInChI=1S/C22H22N4O/c1-14-5-8-17(9-6-14)22-19(26-13-15(2)7-10-21(26)23-22)12-20(27)18-11-16(3)24-25(18)4/h5-11,13H,12H2,1-4H3
InChIKeyRRSWPILKRQBBAT-UHFFFAOYSA-N
XLogP4.09
TPSA52.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.45
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethane;2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 143742261
2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid;hydrochloride
CID 74889750
N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide;oxalic acid
CID 175437042
2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-1-(4-methylthiadiazol-5-yl)ethanone
CID 11302942
2-[2-(4-iodophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylacetamide
CID 10319898
N-methyl-2-[6-methyl-2-[4-(trideuteriomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]-N-(trideuteriomethyl)acetamide
CID 59023546
1,5-dimethyl-N-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]pyrazole-3-carboxamide
CID 59781320
methyl N-[[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]carbamate
CID 11536868
N,N-dimethyl-3-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 13267864
2,3-dihydroxybutanedioic acid;bis(N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide);hydrochloride
CID 77342331
ethyl 2-[2-(4-methoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetate
CID 58763578
[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl propanoate
CID 10518882

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone (CID 11268346) is 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone is Cc1ccc(-c2nc3ccc(C)cn3c2CC(=O)c2cc(C)nn2C)cc1.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone?
The InChIKey is RRSWPILKRQBBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O/c1-14-5-8-17(9-6-14)22-19(26-13-15(2)7-10-21(26)23-22)12-20(27)18-11-16(3)24-25(18)4/h5-11,13H,12H2,1-4H3.
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone?
1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone has a molecular weight of 358.45 g/mol, XLogP of 4.09, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanone is sourced from PubChem (CID 11268346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).