4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one

C21H22N4O2 — CID 70748846

IUPAC4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one
SMILESCc1ccc(N2CCN(C(=O)CCc3cn4ccccc4n3)CC2=O)cc1
InChIInChI=1S/C21H22N4O2/c1-16-5-8-18(9-6-16)25-13-12-24(15-21(25)27)20(26)10-7-17-14-23-11-3-2-4-19(23)22-17/h2-6,8-9,11,14H,7,10,12-13,15H2,1H3
InChIKeyHJWXYMBLTRWZIU-UHFFFAOYSA-N
MW362.43 g/mol
LogP2.45
Rot. Bonds4

About 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one

4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one (PubChem CID 70748846) has the molecular formula C21H22N4O2 and a molecular weight of 362.43 g/mol. Its IUPAC name is 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one.

Molecular Properties

Compound Name4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one
PubChem CID70748846
Molecular FormulaC21H22N4O2
Molecular Weight362.43 g/mol
Exact Mass362.17
IUPAC Name4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one
SMILESCc1ccc(N2CCN(C(=O)CCc3cn4ccccc4n3)CC2=O)cc1
InChIInChI=1S/C21H22N4O2/c1-16-5-8-18(9-6-16)25-13-12-24(15-21(25)27)20(26)10-7-17-14-23-11-3-2-4-19(23)22-17/h2-6,8-9,11,14H,7,10,12-13,15H2,1H3
InChIKeyHJWXYMBLTRWZIU-UHFFFAOYSA-N
XLogP2.45
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methylphenyl)-4-(3-pyrrolidin-1-ylpropanoyl)piperazin-2-one
CID 70741232
1-[3-(2-hydroxyethyl)-4-methylpiperazin-1-yl]-3-imidazo[1,2-a]pyridin-2-ylpropan-1-one
CID 70722103
4-(3-ethoxypropanoyl)-1-(4-methylphenyl)piperazin-2-one
CID 70765820
tert-butyl 4-imidazo[1,2-a]pyridin-2-yl-3-oxopiperazine-1-carboxylate
CID 162624837
1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-3-phenylpropan-1-one
CID 71944000
1-[(3S,4S)-3-hydroxy-3,4-dimethylpyrrolidin-1-yl]-3-imidazo[1,2-a]pyridin-2-ylpropan-1-one
CID 133113552
1-(4-methylphenyl)-4-[(4S)-4-(4-methylpiperazin-1-yl)pentanoyl]piperazin-2-one
CID 96579737
1-(4-methylphenyl)-4-[(4R)-4-morpholin-4-ylpentanoyl]piperazin-2-one
CID 96573400
1-[4-methyl-3-(3-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-(3-methylsulfonylpropanoyl)piperazin-2-one
CID 147705178
1-(4-methylphenyl)-4-(2-pyrazin-2-ylacetyl)piperazin-2-one
CID 70743066
1-cyclopropyl-3-imidazo[1,2-a]pyridin-2-ylpropan-1-one
CID 79417170
1-(4-methylphenyl)-4-[1-(pyrazol-1-ylmethyl)cyclopropanecarbonyl]piperazin-2-one
CID 70739627

Frequently Asked Questions

What is the IUPAC name of 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one?
The IUPAC name of 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one (CID 70748846) is 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one.
What is the SMILES notation for 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one?
The canonical SMILES for 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one is Cc1ccc(N2CCN(C(=O)CCc3cn4ccccc4n3)CC2=O)cc1.
What is the InChIKey of 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one?
The InChIKey is HJWXYMBLTRWZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O2/c1-16-5-8-18(9-6-16)25-13-12-24(15-21(25)27)20(26)10-7-17-14-23-11-3-2-4-19(23)22-17/h2-6,8-9,11,14H,7,10,12-13,15H2,1H3.
What are the key properties of 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one?
4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one has a molecular weight of 362.43 g/mol, XLogP of 2.45, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-imidazo[1,2-a]pyridin-2-ylpropanoyl)-1-(4-methylphenyl)piperazin-2-one is sourced from PubChem (CID 70748846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).