N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide

C26H27N3O2 — CID 171679149

IUPACN-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCOc1ccccc1CN(C)C(=O)Cc1c(-c2ccc(C)cc2)nc2ccc(C)cn12
InChIInChI=1S/C26H27N3O2/c1-18-9-12-20(13-10-18)26-22(29-16-19(2)11-14-24(29)27-26)15-25(30)28(3)17-21-7-5-6-8-23(21)31-4/h5-14,16H,15,17H2,1-4H3
InChIKeyZGSPNRZWNCIJIX-UHFFFAOYSA-N
MW413.52 g/mol
LogP4.83
Rot. Bonds6

About N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide

N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide (PubChem CID 171679149) has the molecular formula C26H27N3O2 and a molecular weight of 413.52 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
PubChem CID171679149
Molecular FormulaC26H27N3O2
Molecular Weight413.52 g/mol
Exact Mass413.21
IUPAC NameN-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCOc1ccccc1CN(C)C(=O)Cc1c(-c2ccc(C)cc2)nc2ccc(C)cn12
InChIInChI=1S/C26H27N3O2/c1-18-9-12-20(13-10-18)26-22(29-16-19(2)11-14-24(29)27-26)15-25(30)28(3)17-21-7-5-6-8-23(21)31-4/h5-14,16H,15,17H2,1-4H3
InChIKeyZGSPNRZWNCIJIX-UHFFFAOYSA-N
XLogP4.83
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.52
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide (CID 171679149) is N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide is COc1ccccc1CN(C)C(=O)Cc1c(-c2ccc(C)cc2)nc2ccc(C)cn12.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The InChIKey is ZGSPNRZWNCIJIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O2/c1-18-9-12-20(13-10-18)26-22(29-16-19(2)11-14-24(29)27-26)15-25(30)28(3)17-21-7-5-6-8-23(21)31-4/h5-14,16H,15,17H2,1-4H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide has a molecular weight of 413.52 g/mol, XLogP of 4.83, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-N-methyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide is sourced from PubChem (CID 171679149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).