6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine

C64H47F11N14O2 — CID 160574493

IUPAC6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine
SMILESFC(F)C(F)(F)Oc1cccc(Nc2nc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cn3ccnc23)c1.Fc1ccccc1-c1cn2ccnc2c(Nc2ccc(N3CCOCC3)cc2)n1.c1ccc(-c2cn3ccnc3c(Nc3ccc4[nH]ccc4c3)n2)cc1
InChIInChI=1S/C22H12F10N4O.C22H20FN5O.C20H15N5/c23-19(24)22(31,32)37-15-3-1-2-14(9-15)34-17-18-33-4-5-36(18)10-16(35-17)11-6-12(20(25,26)27)8-13(7-11)21(28,29)30;23-19-4-2-1-3-18(19)20-15-28-10-9-24-22(28)21(26-20)25-16-5-7-17(8-6-16)27-11-13-29-14-12-27;1-2-4-14(5-3-1)18-13-25-11-10-22-20(25)19(24-18)23-16-6-7-17-15(12-16)8-9-21-17/h1-10,19H,(H,34,35);1-10,15H,11-14H2,(H,25,26);1-13,21H,(H,23,24)
InChIKeyRAYWMFZKUWMSPE-UHFFFAOYSA-N
MW1253.15 g/mol
LogP16.15
Rot. Bonds13

About 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine

6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 160574493) has the molecular formula C64H47F11N14O2 and a molecular weight of 1253.15 g/mol. Its IUPAC name is 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine
PubChem CID160574493
Molecular FormulaC64H47F11N14O2
Molecular Weight1253.15 g/mol
Exact Mass1252.38
IUPAC Name6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine
SMILESFC(F)C(F)(F)Oc1cccc(Nc2nc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cn3ccnc23)c1.Fc1ccccc1-c1cn2ccnc2c(Nc2ccc(N3CCOCC3)cc2)n1.c1ccc(-c2cn3ccnc3c(Nc3ccc4[nH]ccc4c3)n2)cc1
InChIInChI=1S/C22H12F10N4O.C22H20FN5O.C20H15N5/c23-19(24)22(31,32)37-15-3-1-2-14(9-15)34-17-18-33-4-5-36(18)10-16(35-17)11-6-12(20(25,26)27)8-13(7-11)21(28,29)30;23-19-4-2-1-3-18(19)20-15-28-10-9-24-22(28)21(26-20)25-16-5-7-17(8-6-16)27-11-13-29-14-12-27;1-2-4-14(5-3-1)18-13-25-11-10-22-20(25)19(24-18)23-16-6-7-17-15(12-16)8-9-21-17/h1-10,19H,(H,34,35);1-10,15H,11-14H2,(H,25,26);1-13,21H,(H,23,24)
InChIKeyRAYWMFZKUWMSPE-UHFFFAOYSA-N
XLogP16.15
TPSA164.15 Ų
H-Bond Donors4
H-Bond Acceptors15
Rotatable Bonds13
Heavy Atoms91
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001253.15
LogP ≤ 516.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine with MolForge

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Related Compounds

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CID 49832218
4-[2-[3-[(2,6-difluoroanilino)methyl]phenyl]imidazo[1,2-a]pyridin-3-yl]-N-[2-ethoxy-4-(4-propan-2-ylpiperazin-1-yl)phenyl]pyrimidin-2-amine
CID 59860275
2-[3-[2-[5-[5-[(benzylamino)methyl]-3-pyridinyl]-1H-indazol-3-yl]imidazo[4,5-b]pyridin-3-yl]-5-fluorophenoxy]-N,N-dimethylethanamine
CID 118948727
N-(3,4-difluorophenyl)-4-[11-[3-(2-fluoroethoxy)anilino]-3,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl]-N,8-bis(2-fluoroethyl)-8,10-diaza-4-azoniatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-11-amine
CID 123914075
N-[[5-[1-[1-[3-[3-fluoro-5-[2-(5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-1H-benzimidazol-4-yl]phenoxy]propyl]pyrrolidin-3-yl]-3-[4-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-benzimidazol-2-yl]pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]methyl]-1-phenylmethanamine
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4-(6-Aminopurin-9-yl)-2-[[2-[2-[[9-[2-[2-[(6-aminopurin-9-yl)methoxy]ethylamino]ethyl]-8-[[9-[2-[2-[(6-aminopurin-9-yl)methoxy]ethylamino]ethyl]-7-(trifluoromethyl)carbazol-3-yl]methyl]carbazol-3-yl]methoxy]-7-methylcarbazol-9-yl]ethylamino]methyl]oxolane-3,4-diol
CID 139448107
N-[[5-[1-[1-[3-[3-fluoro-5-[2-(5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-1H-benzimidazol-4-yl]phenyl]propyl]pyrrolidin-3-yl]-3-[4-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-1H-benzimidazol-2-yl]pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]methyl]-1-phenylmethanamine
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5-fluoro-N-[2-[3-[8-fluoro-6-[5-fluoro-2-[2-methoxy-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]-3-prop-1-en-2-ylimidazo[1,2-a]pyridin-2-yl]propoxy]-4-(4-methylpiperazin-1-yl)phenyl]-4-(8-fluoro-2-methyl-3-propan-2-ylimidazo[1,2-a]pyridin-6-yl)pyrimidin-2-amine
CID 145449359
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2-Isocyanato-1-methoxy-4-(trifluoromethyl)benzene;1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-[3-[8-(2-pyridin-4-ylimidazol-1-yl)imidazo[1,2-a]pyrazin-6-yl]phenyl]urea;3-[8-(2-pyridin-4-ylimidazol-1-yl)imidazo[1,2-a]pyrazin-6-yl]aniline
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Frequently Asked Questions

What is the IUPAC name of 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine (CID 160574493) is 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine is FC(F)C(F)(F)Oc1cccc(Nc2nc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cn3ccnc23)c1.Fc1ccccc1-c1cn2ccnc2c(Nc2ccc(N3CCOCC3)cc2)n1.c1ccc(-c2cn3ccnc3c(Nc3ccc4[nH]ccc4c3)n2)cc1.
What is the InChIKey of 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is RAYWMFZKUWMSPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H12F10N4O.C22H20FN5O.C20H15N5/c23-19(24)22(31,32)37-15-3-1-2-14(9-15)34-17-18-33-4-5-36(18)10-16(35-17)11-6-12(20(25,26)27)8-13(7-11)21(28,29)30;23-19-4-2-1-3-18(19)20-15-28-10-9-24-22(28)21(26-20)25-16-5-7-17(8-6-16)27-11-13-29-14-12-27;1-2-4-14(5-3-1)18-13-25-11-10-22-20(25)19(24-18)23-16-6-7-17-15(12-16)8-9-21-17/h1-10,19H,(H,34,35);1-10,15H,11-14H2,(H,25,26);1-13,21H,(H,23,24).
What are the key properties of 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine?
6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 1253.15 g/mol, XLogP of 16.15, 13 rotatable bonds, 4 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine;N-(1H-indol-5-yl)-6-phenylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 160574493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).