4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine

C73H73N17O5 — CID 158209389

IUPAC4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine
SMILESCCCNc1nc(-c2cccc(C)c2)cn2ccnc12.CCNc1nc(-c2ccc(O)c(OC)c2)cn2ccnc12.COc1cc(-c2cn3ccnc3c(NC3CC3)n2)ccc1O.c1ccc2cc(-c3cn4ccnc4c(Nc4ccc(N5CCOCC5)cc4)n3)ccc2c1
InChIInChI=1S/C26H23N5O.C16H16N4O2.C16H18N4.C15H16N4O2/c1-2-4-20-17-21(6-5-19(20)3-1)24-18-31-12-11-27-26(31)25(29-24)28-22-7-9-23(10-8-22)30-13-15-32-16-14-30;1-22-14-8-10(2-5-13(14)21)12-9-20-7-6-17-16(20)15(19-12)18-11-3-4-11;1-3-7-17-15-16-18-8-9-20(16)11-14(19-15)13-6-4-5-12(2)10-13;1-3-16-14-15-17-6-7-19(15)9-11(18-14)10-4-5-12(20)13(8-10)21-2/h1-12,17-18H,13-16H2,(H,28,29);2,5-9,11,21H,3-4H2,1H3,(H,18,19);4-6,8-11H,3,7H2,1-2H3,(H,17,19);4-9,20H,3H2,1-2H3,(H,16,18)
InChIKeyGBWQNNFDRSZNST-UHFFFAOYSA-N
MW1268.50 g/mol
LogP13.88
Rot. Bonds16

About 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine

4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 158209389) has the molecular formula C73H73N17O5 and a molecular weight of 1268.50 g/mol. Its IUPAC name is 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine
PubChem CID158209389
Molecular FormulaC73H73N17O5
Molecular Weight1268.50 g/mol
Exact Mass1267.60
IUPAC Name4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine
SMILESCCCNc1nc(-c2cccc(C)c2)cn2ccnc12.CCNc1nc(-c2ccc(O)c(OC)c2)cn2ccnc12.COc1cc(-c2cn3ccnc3c(NC3CC3)n2)ccc1O.c1ccc2cc(-c3cn4ccnc4c(Nc4ccc(N5CCOCC5)cc4)n3)ccc2c1
InChIInChI=1S/C26H23N5O.C16H16N4O2.C16H18N4.C15H16N4O2/c1-2-4-20-17-21(6-5-19(20)3-1)24-18-31-12-11-27-26(31)25(29-24)28-22-7-9-23(10-8-22)30-13-15-32-16-14-30;1-22-14-8-10(2-5-13(14)21)12-9-20-7-6-17-16(20)15(19-12)18-11-3-4-11;1-3-7-17-15-16-18-8-9-20(16)11-14(19-15)13-6-4-5-12(2)10-13;1-3-16-14-15-17-6-7-19(15)9-11(18-14)10-4-5-12(20)13(8-10)21-2/h1-12,17-18H,13-16H2,(H,28,29);2,5-9,11,21H,3-4H2,1H3,(H,18,19);4-6,8-11H,3,7H2,1-2H3,(H,17,19);4-9,20H,3H2,1-2H3,(H,16,18)
InChIKeyGBWQNNFDRSZNST-UHFFFAOYSA-N
XLogP13.88
TPSA240.27 Ų
H-Bond Donors6
H-Bond Acceptors22
Rotatable Bonds16
Heavy Atoms95
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001268.50
LogP ≤ 513.88
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine with MolForge

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Related Compounds

2-Cyclopropyl-3-(4-methoxy-3-methylphenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazine;4-[2-cyclopropyl-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3-fluorophenol;bis(3,5-difluoro-4-[2-propan-2-yl-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]phenol);3-fluoro-5-methyl-4-[2-methyl-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]phenol;2-methoxy-5-[2-propyl-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]phenol
CID 157781151
8-tert-butyl-2-(2-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)phenol;8-tert-butyl-2-(1H-indol-3-yl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
CID 159712568
6-[3,5-bis(trifluoromethyl)phenyl]-N-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine;2-[N-ethyl-4-[[6-[2-(hydroxymethyl)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]anilino]ethanol;6-(2-fluorophenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 160001574
[3-[2-(1,3-benzodioxol-5-ylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;[3-[2-(cyclohexylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;[3-[2-[(2,4-dimethylphenyl)methylamino]pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-[(4-methylphenyl)methylamino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;2-[[2-(4-fluorophenyl)-3-[2-[[4-(trifluoromethyl)phenyl]methylamino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methyl-methylamino]-N,N-dimethylacetamide
CID 161313890
8-tert-butyl-2-(2-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridine;3-(8-tert-butylimidazo[1,2-a]pyridin-2-yl)phenol;8-tert-butyl-2-(1H-indol-3-yl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine;8-tert-butyl-2-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridine;8-tert-butyl-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
CID 164968029
5-[3-(Cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trihydroxy-3-methylnaphthalen-2-yl]-3-methylnaphthalene-1,6,7-triol
CID 155812195
N-cyclohexyl-2-[6-[5-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-1,6,7-trimethoxy-3-methylnaphthalen-2-yl]-2,3,5-trimethoxy-7-methylnaphthalen-1-yl]imidazo[1,2-a]pyridin-3-amine
CID 155810703
4-[9-benzyl-6-(1H-indol-6-yl)purin-2-yl]morpholine;3-[9-[(2,6-difluorophenyl)methyl]-2-morpholin-4-ylpurin-6-yl]phenol;3-[9-[(4-methoxyphenyl)methyl]-2-morpholin-4-ylpurin-6-yl]phenol;3-[9-[(3-methylphenyl)methyl]-2-morpholin-4-ylpurin-6-yl]phenol
CID 123637067
4-[6-(1H-indol-5-yl)-9-[(3-methylphenyl)methyl]purin-2-yl]morpholine;3-[2-morpholin-4-yl-9-(naphthalen-2-ylmethyl)purin-6-yl]phenol
CID 123828189
2-Methoxy-4-(6-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridin-2-yl)phenol
CID 136026705
2-Methoxy-4-(7-naphthalen-2-yl-3-piperidin-4-ylimidazo[4,5-b]pyridin-2-yl)phenol
CID 136116546
2-Methoxy-4-[8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyridin-5-yl]phenol
CID 136419495

Frequently Asked Questions

What is the IUPAC name of 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine (CID 158209389) is 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine is CCCNc1nc(-c2cccc(C)c2)cn2ccnc12.CCNc1nc(-c2ccc(O)c(OC)c2)cn2ccnc12.COc1cc(-c2cn3ccnc3c(NC3CC3)n2)ccc1O.c1ccc2cc(-c3cn4ccnc4c(Nc4ccc(N5CCOCC5)cc4)n3)ccc2c1.
What is the InChIKey of 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is GBWQNNFDRSZNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N5O.C16H16N4O2.C16H18N4.C15H16N4O2/c1-2-4-20-17-21(6-5-19(20)3-1)24-18-31-12-11-27-26(31)25(29-24)28-22-7-9-23(10-8-22)30-13-15-32-16-14-30;1-22-14-8-10(2-5-13(14)21)12-9-20-7-6-17-16(20)15(19-12)18-11-3-4-11;1-3-7-17-15-16-18-8-9-20(16)11-14(19-15)13-6-4-5-12(2)10-13;1-3-16-14-15-17-6-7-19(15)9-11(18-14)10-4-5-12(20)13(8-10)21-2/h1-12,17-18H,13-16H2,(H,28,29);2,5-9,11,21H,3-4H2,1H3,(H,18,19);4-6,8-11H,3,7H2,1-2H3,(H,17,19);4-9,20H,3H2,1-2H3,(H,16,18).
What are the key properties of 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine?
4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 1268.50 g/mol, XLogP of 13.88, 16 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[8-(cyclopropylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;4-[8-(ethylamino)imidazo[1,2-a]pyrazin-6-yl]-2-methoxyphenol;6-(3-methylphenyl)-N-propylimidazo[1,2-a]pyrazin-8-amine;N-(4-morpholin-4-ylphenyl)-6-naphthalen-2-ylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 158209389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).