[8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate

C18H15Cl2N3O3 — CID 57093826

IUPAC[8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate
SMILESCC(=O)OCc1c(C)nc2c(NC(=O)c3c(Cl)cccc3Cl)cccn12
InChIInChI=1S/C18H15Cl2N3O3/c1-10-15(9-26-11(2)24)23-8-4-7-14(17(23)21-10)22-18(25)16-12(19)5-3-6-13(16)20/h3-8H,9H2,1-2H3,(H,22,25)
InChIKeyCFJPWEREWOTVBB-UHFFFAOYSA-N
MW392.24 g/mol
LogP4.26
Rot. Bonds4

About [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate

[8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate (PubChem CID 57093826) has the molecular formula C18H15Cl2N3O3 and a molecular weight of 392.24 g/mol. Its IUPAC name is [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate.

Molecular Properties

Compound Name[8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate
PubChem CID57093826
Molecular FormulaC18H15Cl2N3O3
Molecular Weight392.24 g/mol
Exact Mass391.05
IUPAC Name[8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate
SMILESCC(=O)OCc1c(C)nc2c(NC(=O)c3c(Cl)cccc3Cl)cccn12
InChIInChI=1S/C18H15Cl2N3O3/c1-10-15(9-26-11(2)24)23-8-4-7-14(17(23)21-10)22-18(25)16-12(19)5-3-6-13(16)20/h3-8H,9H2,1-2H3,(H,22,25)
InChIKeyCFJPWEREWOTVBB-UHFFFAOYSA-N
XLogP4.26
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.24
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-dichloro-N-[3-(hydroxymethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]benzamide
CID 54237289
2,6-dichloro-N-[2-methyl-3-(2,2,2-trifluoroethoxymethyl)imidazo[1,2-a]pyridin-8-yl]benzamide
CID 67767729
2,6-dichloro-N-[3-[2-(dimethylamino)-2-oxoethyl]-2-methylimidazo[1,2-a]pyridin-8-yl]benzamide
CID 67767428
2,6-dichloro-N-[2-methyl-3-[2-oxo-2-(piperidin-1-ylamino)ethyl]imidazo[1,2-a]pyridin-8-yl]benzamide
CID 57028334
2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide
CID 54015598
2,6-dichloro-N-[3-(2-imidazol-1-ylethyl)-2-methylimidazo[1,2-a]pyridin-8-yl]benzamide
CID 57001168
8-[(2,6-dichlorobenzoyl)amino]-3-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 54366359
ethyl 3-bromo-8-[(2,6-dichlorobenzoyl)amino]imidazo[1,2-a]pyridine-2-carboxylate
CID 57020246
ethyl 8-[(2,6-dichlorobenzoyl)amino]-2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxylate
CID 57170960
2,6-dichloro-N-[2-methyl-3-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]imidazo[1,2-a]pyridin-8-yl]benzamide;hydrochloride
CID 67767652
N-[3-[1-amino-3-(furan-2-yl)-1-oxopropan-2-yl]-2-methylimidazo[1,2-a]pyridin-8-yl]-2,6-dichlorobenzamide
CID 67768136
[7-[(2,6-dichlorobenzoyl)amino]-2-methyl-1-benzofuran-3-yl]methyl acetate
CID 70198733

Frequently Asked Questions

What is the IUPAC name of [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate?
The IUPAC name of [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate (CID 57093826) is [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate.
What is the SMILES notation for [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate?
The canonical SMILES for [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate is CC(=O)OCc1c(C)nc2c(NC(=O)c3c(Cl)cccc3Cl)cccn12.
What is the InChIKey of [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate?
The InChIKey is CFJPWEREWOTVBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O3/c1-10-15(9-26-11(2)24)23-8-4-7-14(17(23)21-10)22-18(25)16-12(19)5-3-6-13(16)20/h3-8H,9H2,1-2H3,(H,22,25).
What are the key properties of [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate?
[8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate has a molecular weight of 392.24 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [8-[(2,6-dichlorobenzoyl)amino]-2-methylimidazo[1,2-a]pyridin-3-yl]methyl acetate is sourced from PubChem (CID 57093826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).