1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone

C73H78Cl4F2N22O5 — CID 161113927

IUPAC1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
SMILESCC(=O)N1CCN(C(=O)C(C)Nc2c(-c3ccc(N(C)C)cc3)nc3cnccn23)CC1.CC(F)(F)Oc1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cncc3Cl)CC2)cc1.CN(C)c1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cncc3Cl)CC2)cc1
InChIInChI=1S/C25H23Cl2F2N7O2.C25H26Cl2N8O.C23H29N7O2/c1-25(28,29)38-17-4-2-16(3-5-17)22-24(36-7-6-30-14-20(36)33-22)32-15-21(37)34-8-10-35(11-9-34)23-18(26)12-31-13-19(23)27;1-32(2)18-5-3-17(4-6-18)23-25(35-8-7-28-15-21(35)31-23)30-16-22(36)33-9-11-34(12-10-33)24-19(26)13-29-14-20(24)27;1-16(23(32)29-13-11-28(12-14-29)17(2)31)25-22-21(26-20-15-24-9-10-30(20)22)18-5-7-19(8-6-18)27(3)4/h2-7,12-14,32H,8-11,15H2,1H3;3-8,13-15,30H,9-12,16H2,1-2H3;5-10,15-16,25H,11-14H2,1-4H3
InChIKeyUKBGIAQGXBZWGK-UHFFFAOYSA-N
MW1523.38 g/mol
LogP10.73
Rot. Bonds18

About 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone

1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone (PubChem CID 161113927) has the molecular formula C73H78Cl4F2N22O5 and a molecular weight of 1523.38 g/mol. Its IUPAC name is 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone.

Molecular Properties

Compound Name1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
PubChem CID161113927
Molecular FormulaC73H78Cl4F2N22O5
Molecular Weight1523.38 g/mol
Exact Mass1520.52
IUPAC Name1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
SMILESCC(=O)N1CCN(C(=O)C(C)Nc2c(-c3ccc(N(C)C)cc3)nc3cnccn23)CC1.CC(F)(F)Oc1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cncc3Cl)CC2)cc1.CN(C)c1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cncc3Cl)CC2)cc1
InChIInChI=1S/C25H23Cl2F2N7O2.C25H26Cl2N8O.C23H29N7O2/c1-25(28,29)38-17-4-2-16(3-5-17)22-24(36-7-6-30-14-20(36)33-22)32-15-21(37)34-8-10-35(11-9-34)23-18(26)12-31-13-19(23)27;1-32(2)18-5-3-17(4-6-18)23-25(35-8-7-28-15-21(35)31-23)30-16-22(36)33-9-11-34(12-10-33)24-19(26)13-29-14-20(24)27;1-16(23(32)29-13-11-28(12-14-29)17(2)31)25-22-21(26-20-15-24-9-10-30(20)22)18-5-7-19(8-6-18)27(3)4/h2-7,12-14,32H,8-11,15H2,1H3;3-8,13-15,30H,9-12,16H2,1-2H3;5-10,15-16,25H,11-14H2,1-4H3
InChIKeyUKBGIAQGXBZWGK-UHFFFAOYSA-N
XLogP10.73
TPSA255.87 Ų
H-Bond Donors3
H-Bond Acceptors23
Rotatable Bonds18
Heavy Atoms106
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001523.38
LogP ≤ 510.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1023

Analyze 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone with MolForge

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Related Compounds

6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[(5-chloro-2-pyridyl)oxy]phenyl]quinazolin-4-amine
CID 163201723
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[[6-(trifluoromethyl)-2-pyridyl]oxy]phenyl]quinazolin-4-amine
CID 163201738
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[4-(trifluoromethyl)phenoxy]phenyl]pyrido[3,2-d]pyrimidin-4-amine
CID 163201778
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[4-(trifluoromethyl)phenoxy]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 163201999
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[4-(trifluoromethyl)phenoxy]phenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine
CID 163202021
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[4-(trifluoromethyl)phenoxy]phenyl]-9H-purin-6-amine
CID 163202022
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[9-[4-(trifluoromethyl)phenyl]-3,9-diazaspiro[5.5]undecan-3-yl]phenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine
CID 163202068
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;5-methyl-N-[4-[4-(trifluoromethyl)phenoxy]phenyl]pyrrolo[3,2-d]pyrimidin-4-amine
CID 163202092
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[4-[4-(trifluoromethyl)phenoxy]phenyl]pyrido[2,3-d]pyrimidin-4-amine
CID 163202220
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;N-[[6-[3-(trifluoromethyl)phenoxy]-3-pyridyl]methyl]quinazolin-4-amine
CID 163202262
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;2,7-dimethyl-N-[4-[4-(trifluoromethyl)pyrimidin-2-yl]oxyphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 163202296
1-[4-(3,5-Dichloropyridin-4-yl)piperazin-1-yl]-2-[[2-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone
CID 56649455

Frequently Asked Questions

What is the IUPAC name of 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
The IUPAC name of 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone (CID 161113927) is 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)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-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
The canonical SMILES for 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone is CC(=O)N1CCN(C(=O)C(C)Nc2c(-c3ccc(N(C)C)cc3)nc3cnccn23)CC1.CC(F)(F)Oc1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cncc3Cl)CC2)cc1.CN(C)c1ccc(-c2nc3cnccn3c2NCC(=O)N2CCN(c3c(Cl)cncc3Cl)CC2)cc1.
What is the InChIKey of 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
The InChIKey is UKBGIAQGXBZWGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23Cl2F2N7O2.C25H26Cl2N8O.C23H29N7O2/c1-25(28,29)38-17-4-2-16(3-5-17)22-24(36-7-6-30-14-20(36)33-22)32-15-21(37)34-8-10-35(11-9-34)23-18(26)12-31-13-19(23)27;1-32(2)18-5-3-17(4-6-18)23-25(35-8-7-28-15-21(35)31-23)30-16-22(36)33-9-11-34(12-10-33)24-19(26)13-29-14-20(24)27;1-16(23(32)29-13-11-28(12-14-29)17(2)31)25-22-21(26-20-15-24-9-10-30(20)22)18-5-7-19(8-6-18)27(3)4/h2-7,12-14,32H,8-11,15H2,1H3;3-8,13-15,30H,9-12,16H2,1-2H3;5-10,15-16,25H,11-14H2,1-4H3.
What are the key properties of 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone?
1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone has a molecular weight of 1523.38 g/mol, XLogP of 10.73, 18 rotatable bonds, 3 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-acetylpiperazin-1-yl)-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]propan-1-one;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(1,1-difluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone;1-[4-(3,5-dichloro-4-pyridinyl)piperazin-1-yl]-2-[[2-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazin-3-yl]amino]ethanone is sourced from PubChem (CID 161113927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).