3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one

C22H27N5O2 — CID 53039983

IUPAC3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one
SMILESCOc1ccccc1-c1nc2cnccn2c1NCCC(=O)N1CCC(C)CC1
InChIInChI=1S/C22H27N5O2/c1-16-8-12-26(13-9-16)20(28)7-10-24-22-21(17-5-3-4-6-18(17)29-2)25-19-15-23-11-14-27(19)22/h3-6,11,14-16,24H,7-10,12-13H2,1-2H3
InChIKeyQFNWABBQVCDBBZ-UHFFFAOYSA-N
MW393.49 g/mol
LogP3.47
Rot. Bonds6

About 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one

3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one (PubChem CID 53039983) has the molecular formula C22H27N5O2 and a molecular weight of 393.49 g/mol. Its IUPAC name is 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one
PubChem CID53039983
Molecular FormulaC22H27N5O2
Molecular Weight393.49 g/mol
Exact Mass393.22
IUPAC Name3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one
SMILESCOc1ccccc1-c1nc2cnccn2c1NCCC(=O)N1CCC(C)CC1
InChIInChI=1S/C22H27N5O2/c1-16-8-12-26(13-9-16)20(28)7-10-24-22-21(17-5-3-4-6-18(17)29-2)25-19-15-23-11-14-27(19)22/h3-6,11,14-16,24H,7-10,12-13H2,1-2H3
InChIKeyQFNWABBQVCDBBZ-UHFFFAOYSA-N
XLogP3.47
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.49
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[2-(2-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-piperidin-1-ylpropan-1-one
CID 53039884
3-[[2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-piperidin-1-ylpropan-1-one
CID 53039915
1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]propan-1-one
CID 53039725
N-(3,4-difluorophenyl)-3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039989
3-[[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-[(3R)-3-methylpiperidin-1-yl]propan-1-one
CID 95058468
3-[[2-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-morpholin-4-ylpropan-1-one
CID 53039750
1-(azepan-1-yl)-3-[[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one
CID 53040031
3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperidin-1-yl)propan-1-one
CID 5130333
2-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
CID 135674529
N-(3,5-dimethylphenyl)-3-[[2-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]propanamide
CID 53039920
N-(2-methylbutan-2-yl)-2-[2-(pyridin-2-ylmethoxy)phenyl]imidazo[1,2-a]pyrazin-3-amine
CID 95802730
3-(4-chloro-2,5-dimethoxyanilino)-1-(4-methylpiperidin-1-yl)propan-1-one
CID 109014463

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one?
The IUPAC name of 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one (CID 53039983) is 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one.
What is the SMILES notation for 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one?
The canonical SMILES for 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one is COc1ccccc1-c1nc2cnccn2c1NCCC(=O)N1CCC(C)CC1.
What is the InChIKey of 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one?
The InChIKey is QFNWABBQVCDBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O2/c1-16-8-12-26(13-9-16)20(28)7-10-24-22-21(17-5-3-4-6-18(17)29-2)25-19-15-23-11-14-27(19)22/h3-6,11,14-16,24H,7-10,12-13H2,1-2H3.
What are the key properties of 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one?
3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one has a molecular weight of 393.49 g/mol, XLogP of 3.47, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(2-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-(4-methylpiperidin-1-yl)propan-1-one is sourced from PubChem (CID 53039983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).