6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine

C87H84N36O — CID 159111117

IUPAC6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCNC(C)c1cn2c(-c3cnn(C)c3)cnc2c(Nc2ccc(-n3ccnc3)cc2)n1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(C(N)=O)cn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(C4=CCNCC4)cn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(CCN)cn23)cn1
InChIInChI=1S/C24H23N9.C22H23N9.C21H21N9.C20H17N9O/c1-31-14-18(12-28-31)22-13-27-24-23(30-21(15-33(22)24)17-6-8-25-9-7-17)29-19-2-4-20(5-3-19)32-11-10-26-16-32;1-15(23-2)19-13-31-20(16-10-26-29(3)12-16)11-25-22(31)21(28-19)27-17-4-6-18(7-5-17)30-9-8-24-14-30;1-28-12-15(10-25-28)19-11-24-21-20(27-17(6-7-22)13-30(19)21)26-16-2-4-18(5-3-16)29-9-8-23-14-29;1-27-10-13(8-24-27)17-9-23-20-19(26-16(18(21)30)11-29(17)20)25-14-2-4-15(5-3-14)28-7-6-22-12-28/h2-6,10-16,25H,7-9H2,1H3,(H,29,30);4-15,23H,1-3H3,(H,27,28);2-5,8-14H,6-7,22H2,1H3,(H,26,27);2-12H,1H3,(H2,21,30)(H,25,26)
InChIKeyKEMSFPMHOOLNCY-UHFFFAOYSA-N
MW1649.88 g/mol
LogP11.49
Rot. Bonds22

About 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine

6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 159111117) has the molecular formula C87H84N36O and a molecular weight of 1649.88 g/mol. Its IUPAC name is 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID159111117
Molecular FormulaC87H84N36O
Molecular Weight1649.88 g/mol
Exact Mass1648.76
IUPAC Name6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCNC(C)c1cn2c(-c3cnn(C)c3)cnc2c(Nc2ccc(-n3ccnc3)cc2)n1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(C(N)=O)cn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(C4=CCNCC4)cn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(CCN)cn23)cn1
InChIInChI=1S/C24H23N9.C22H23N9.C21H21N9.C20H17N9O/c1-31-14-18(12-28-31)22-13-27-24-23(30-21(15-33(22)24)17-6-8-25-9-7-17)29-19-2-4-20(5-3-19)32-11-10-26-16-32;1-15(23-2)19-13-31-20(16-10-26-29(3)12-16)11-25-22(31)21(28-19)27-17-4-6-18(7-5-17)30-9-8-24-14-30;1-28-12-15(10-25-28)19-11-24-21-20(27-17(6-7-22)13-30(19)21)26-16-2-4-18(5-3-16)29-9-8-23-14-29;1-27-10-13(8-24-27)17-9-23-20-19(26-16(18(21)30)11-29(17)20)25-14-2-4-15(5-3-14)28-7-6-22-12-28/h2-6,10-16,25H,7-9H2,1H3,(H,29,30);4-15,23H,1-3H3,(H,27,28);2-5,8-14H,6-7,22H2,1H3,(H,26,27);2-12H,1H3,(H2,21,30)(H,25,26)
InChIKeyKEMSFPMHOOLNCY-UHFFFAOYSA-N
XLogP11.49
TPSA404.61 Ų
H-Bond Donors8
H-Bond Acceptors36
Rotatable Bonds22
Heavy Atoms124
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001649.88
LogP ≤ 511.49
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1036

Analyze 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine (CID 159111117) is 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine is CNC(C)c1cn2c(-c3cnn(C)c3)cnc2c(Nc2ccc(-n3ccnc3)cc2)n1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(C(N)=O)cn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(C4=CCNCC4)cn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(CCN)cn23)cn1.
What is the InChIKey of 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is KEMSFPMHOOLNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N9.C22H23N9.C21H21N9.C20H17N9O/c1-31-14-18(12-28-31)22-13-27-24-23(30-21(15-33(22)24)17-6-8-25-9-7-17)29-19-2-4-20(5-3-19)32-11-10-26-16-32;1-15(23-2)19-13-31-20(16-10-26-29(3)12-16)11-25-22(31)21(28-19)27-17-4-6-18(7-5-17)30-9-8-24-14-30;1-28-12-15(10-25-28)19-11-24-21-20(27-17(6-7-22)13-30(19)21)26-16-2-4-18(5-3-16)29-9-8-23-14-29;1-27-10-13(8-24-27)17-9-23-20-19(26-16(18(21)30)11-29(17)20)25-14-2-4-15(5-3-14)28-7-6-22-12-28/h2-6,10-16,25H,7-9H2,1H3,(H,29,30);4-15,23H,1-3H3,(H,27,28);2-5,8-14H,6-7,22H2,1H3,(H,26,27);2-12H,1H3,(H2,21,30)(H,25,26).
What are the key properties of 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine?
6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 1649.88 g/mol, XLogP of 11.49, 22 rotatable bonds, 8 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminoethyl)-N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;8-(4-imidazol-1-ylanilino)-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide;N-(4-imidazol-1-ylphenyl)-6-[1-(methylamino)ethyl]-3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine;N-(4-imidazol-1-ylphenyl)-3-(1-methylpyrazol-4-yl)-6-(1,2,3,6-tetrahydropyridin-4-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 159111117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).