1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone

C26H27Cl2N7O — CID 56837127

IUPAC1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
SMILESCN(C)c1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)cc1
InChIInChI=1S/C26H27Cl2N7O/c1-32(2)19-8-6-18(7-9-19)24-26(35-11-10-29-16-22(35)31-24)30-17-23(36)33-12-14-34(15-13-33)25-20(27)4-3-5-21(25)28/h3-11,16,30H,12-15,17H2,1-2H3
InChIKeyTZWWFRPTBCCWCA-UHFFFAOYSA-N
MW524.46 g/mol
LogP4.53
Rot. Bonds6

About 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone

1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone (PubChem CID 56837127) has the molecular formula C26H27Cl2N7O and a molecular weight of 524.46 g/mol. Its IUPAC name is 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone.

Molecular Properties

Compound Name1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
PubChem CID56837127
Molecular FormulaC26H27Cl2N7O
Molecular Weight524.46 g/mol
Exact Mass523.17
IUPAC Name1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
SMILESCN(C)c1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)cc1
InChIInChI=1S/C26H27Cl2N7O/c1-32(2)19-8-6-18(7-9-19)24-26(35-11-10-29-16-22(35)31-24)30-17-23(36)33-12-14-34(15-13-33)25-20(27)4-3-5-21(25)28/h3-11,16,30H,12-15,17H2,1-2H3
InChIKeyTZWWFRPTBCCWCA-UHFFFAOYSA-N
XLogP4.53
TPSA69.01 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500524.46
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone 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

1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
CID 56836935
1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-(1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
CID 56837007
3-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]benzoic acid
CID 53003286
4-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]benzoic acid
CID 53003283
methyl 3-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]benzoate
CID 53207862
4,6-dimethyl-6-[4-[2-[[2-(4-pyrrolidin-1-ylphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]acetyl]piperazin-1-yl]cyclohex-2-ene-1-carbonitrile
CID 123923899
3-[[2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino]-1-piperidin-1-ylpropan-1-one
CID 53039915
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
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-chloro-2-methylphenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine
CID 46778909
N-(1,3-benzodioxol-5-yl)-2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-amine
CID 7299187

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
The IUPAC name of 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone (CID 56837127) is 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone.
What is the SMILES notation for 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
The canonical SMILES for 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone is CN(C)c1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cccc3Cl)CC2)cc1.
What is the InChIKey of 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
The InChIKey is TZWWFRPTBCCWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27Cl2N7O/c1-32(2)19-8-6-18(7-9-19)24-26(35-11-10-29-16-22(35)31-24)30-17-23(36)33-12-14-34(15-13-33)25-20(27)4-3-5-21(25)28/h3-11,16,30H,12-15,17H2,1-2H3.
What are the key properties of 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone has a molecular weight of 524.46 g/mol, XLogP of 4.53, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,6-dichlorophenyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone is sourced from PubChem (CID 56837127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).