3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide

C26H26N4O3 — CID 46690670

IUPAC3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCOc1ccc(C(CC(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)NC(C)=O)cc1
InChIInChI=1S/C26H26N4O3/c1-17-8-7-15-30-25(17)29-24(20-9-5-4-6-10-20)26(30)28-23(32)16-22(27-18(2)31)19-11-13-21(33-3)14-12-19/h4-15,22H,16H2,1-3H3,(H,27,31)(H,28,32)
InChIKeyQJSMREJWVFKVPB-UHFFFAOYSA-N
MW442.52 g/mol
LogP4.52
Rot. Bonds7

About 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide

3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide (PubChem CID 46690670) has the molecular formula C26H26N4O3 and a molecular weight of 442.52 g/mol. Its IUPAC name is 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide.

Molecular Properties

Compound Name3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
PubChem CID46690670
Molecular FormulaC26H26N4O3
Molecular Weight442.52 g/mol
Exact Mass442.20
IUPAC Name3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCOc1ccc(C(CC(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)NC(C)=O)cc1
InChIInChI=1S/C26H26N4O3/c1-17-8-7-15-30-25(17)29-24(20-9-5-4-6-10-20)26(30)28-23(32)16-22(27-18(2)31)19-11-13-21(33-3)14-12-19/h4-15,22H,16H2,1-3H3,(H,27,31)(H,28,32)
InChIKeyQJSMREJWVFKVPB-UHFFFAOYSA-N
XLogP4.52
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.52
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2,5-dimethoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 46539218
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 55756203
3-acetamido-N-(2-ethylphenyl)-3-(4-methoxyphenyl)propanamide
CID 17436555
(3R)-3-acetamido-3-(4-methoxyphenyl)-N-(4-phenoxyphenyl)propanamide
CID 30685077
(3S)-3-acetamido-3-(4-methoxyphenyl)-N-pyridin-2-ylpropanamide
CID 29466251
2-(2-fluorophenoxy)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 40656268
3-acetamido-3-(4-methoxyphenyl)-N-(2-propan-2-ylphenyl)propanamide
CID 17436814
3-acetamido-3-(4-methoxyphenyl)-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]propanamide
CID 134011351
(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide
CID 2599103
3-acetamido-3-(4-methoxyphenyl)-N-[2-(2-methylphenyl)ethyl]propanamide
CID 86906508
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide
CID 55540978
5-methyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-1,2-oxazole-3-carboxamide
CID 60520237

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
The IUPAC name of 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide (CID 46690670) is 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide.
What is the SMILES notation for 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
The canonical SMILES for 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide is COc1ccc(C(CC(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)NC(C)=O)cc1.
What is the InChIKey of 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
The InChIKey is QJSMREJWVFKVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O3/c1-17-8-7-15-30-25(17)29-24(20-9-5-4-6-10-20)26(30)28-23(32)16-22(27-18(2)31)19-11-13-21(33-3)14-12-19/h4-15,22H,16H2,1-3H3,(H,27,31)(H,28,32).
What are the key properties of 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide has a molecular weight of 442.52 g/mol, XLogP of 4.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-3-(4-methoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide is sourced from PubChem (CID 46690670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).