2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone

C124H130N24O11S2 — CID 158104496

IUPAC2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone
SMILESNc1ccc(-c2ccccc2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccccc2)cc1CC(=O)c1cnc(N2CCNCC2)o1.Nc1ccc(-c2ccco2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccco2)cc1CC(=O)c1cnc(N2CCNCC2)o1.Nc1ccc(-c2cccs2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2cccs2)cc1CC(=O)c1cnc(N2CCNCC2)o1
InChIInChI=1S/C23H24N4O.2C21H22N4O2.C21H22N4OS.C19H20N4O3.C19H20N4O2S/c24-21-8-6-18(17-4-2-1-3-5-17)14-19(21)15-23(28)22-9-7-20(16-26-22)27-12-10-25-11-13-27;22-18-5-3-15(21-2-1-11-27-21)12-16(18)13-20(26)19-6-4-17(14-24-19)25-9-7-23-8-10-25;22-18-7-6-16(15-4-2-1-3-5-15)12-17(18)13-19(26)20-14-24-21(27-20)25-10-8-23-9-11-25;22-18-5-3-15(21-2-1-11-27-21)12-16(18)13-20(26)19-6-4-17(14-24-19)25-9-7-23-8-10-25;20-15-4-3-13(17-2-1-9-25-17)10-14(15)11-16(24)18-12-22-19(26-18)23-7-5-21-6-8-23;20-15-4-3-13(18-2-1-9-26-18)10-14(15)11-16(24)17-12-22-19(25-17)23-7-5-21-6-8-23/h1-9,14,16,25H,10-13,15,24H2;1-6,11-12,14,23H,7-10,13,22H2;1-7,12,14,23H,8-11,13,22H2;1-6,11-12,14,23H,7-10,13,22H2;2*1-4,9-10,12,21H,5-8,11,20H2
InChIKeyFPRCGDYYNOQHMN-UHFFFAOYSA-N
MW2196.69 g/mol
LogP17.08
Rot. Bonds30

About 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone

2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone (PubChem CID 158104496) has the molecular formula C124H130N24O11S2 and a molecular weight of 2196.69 g/mol. Its IUPAC name is 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone.

Molecular Properties

Compound Name2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone
PubChem CID158104496
Molecular FormulaC124H130N24O11S2
Molecular Weight2196.69 g/mol
Exact Mass2194.98
IUPAC Name2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone
SMILESNc1ccc(-c2ccccc2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccccc2)cc1CC(=O)c1cnc(N2CCNCC2)o1.Nc1ccc(-c2ccco2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccco2)cc1CC(=O)c1cnc(N2CCNCC2)o1.Nc1ccc(-c2cccs2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2cccs2)cc1CC(=O)c1cnc(N2CCNCC2)o1
InChIInChI=1S/C23H24N4O.2C21H22N4O2.C21H22N4OS.C19H20N4O3.C19H20N4O2S/c24-21-8-6-18(17-4-2-1-3-5-17)14-19(21)15-23(28)22-9-7-20(16-26-22)27-12-10-25-11-13-27;22-18-5-3-15(21-2-1-11-27-21)12-16(18)13-20(26)19-6-4-17(14-24-19)25-9-7-23-8-10-25;22-18-7-6-16(15-4-2-1-3-5-15)12-17(18)13-19(26)20-14-24-21(27-20)25-10-8-23-9-11-25;22-18-5-3-15(21-2-1-11-27-21)12-16(18)13-20(26)19-6-4-17(14-24-19)25-9-7-23-8-10-25;20-15-4-3-13(17-2-1-9-25-17)10-14(15)11-16(24)18-12-22-19(26-18)23-7-5-21-6-8-23;20-15-4-3-13(18-2-1-9-26-18)10-14(15)11-16(24)17-12-22-19(25-17)23-7-5-21-6-8-23/h1-9,14,16,25H,10-13,15,24H2;1-6,11-12,14,23H,7-10,13,22H2;1-7,12,14,23H,8-11,13,22H2;1-6,11-12,14,23H,7-10,13,22H2;2*1-4,9-10,12,21H,5-8,11,20H2
InChIKeyFPRCGDYYNOQHMN-UHFFFAOYSA-N
XLogP17.08
TPSA493.20 Ų
H-Bond Donors12
H-Bond Acceptors37
Rotatable Bonds30
Heavy Atoms161
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002196.69
LogP ≤ 517.08
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?
The IUPAC name of 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone (CID 158104496) is 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone.
What is the SMILES notation for 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?
The canonical SMILES for 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone is Nc1ccc(-c2ccccc2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccccc2)cc1CC(=O)c1cnc(N2CCNCC2)o1.Nc1ccc(-c2ccco2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2ccco2)cc1CC(=O)c1cnc(N2CCNCC2)o1.Nc1ccc(-c2cccs2)cc1CC(=O)c1ccc(N2CCNCC2)cn1.Nc1ccc(-c2cccs2)cc1CC(=O)c1cnc(N2CCNCC2)o1.
What is the InChIKey of 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?
The InChIKey is FPRCGDYYNOQHMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O.2C21H22N4O2.C21H22N4OS.C19H20N4O3.C19H20N4O2S/c24-21-8-6-18(17-4-2-1-3-5-17)14-19(21)15-23(28)22-9-7-20(16-26-22)27-12-10-25-11-13-27;22-18-5-3-15(21-2-1-11-27-21)12-16(18)13-20(26)19-6-4-17(14-24-19)25-9-7-23-8-10-25;22-18-7-6-16(15-4-2-1-3-5-15)12-17(18)13-19(26)20-14-24-21(27-20)25-10-8-23-9-11-25;22-18-5-3-15(21-2-1-11-27-21)12-16(18)13-20(26)19-6-4-17(14-24-19)25-9-7-23-8-10-25;20-15-4-3-13(17-2-1-9-25-17)10-14(15)11-16(24)18-12-22-19(26-18)23-7-5-21-6-8-23;20-15-4-3-13(18-2-1-9-26-18)10-14(15)11-16(24)17-12-22-19(25-17)23-7-5-21-6-8-23/h1-9,14,16,25H,10-13,15,24H2;1-6,11-12,14,23H,7-10,13,22H2;1-7,12,14,23H,8-11,13,22H2;1-6,11-12,14,23H,7-10,13,22H2;2*1-4,9-10,12,21H,5-8,11,20H2.
What are the key properties of 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone?
2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone has a molecular weight of 2196.69 g/mol, XLogP of 17.08, 30 rotatable bonds, 12 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-amino-5-(furan-2-yl)phenyl]-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-[2-amino-5-(furan-2-yl)phenyl]-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-phenylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-phenylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(2-piperazin-1-yl-1,3-oxazol-5-yl)ethanone;2-(2-amino-5-thiophen-2-ylphenyl)-1-(5-piperazin-1-yl-2-pyridinyl)ethanone is sourced from PubChem (CID 158104496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).