6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine

C102H85F8N29OS — CID 159999874

IUPAC6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine
SMILESCc1cc(C)c2nc(C)n(-c3cncc(Nc4ccc(C(F)(F)F)cc4)n3)c2c1.Cc1nc2cc(F)c(F)cc2n1-c1cncc(Nc2ccc(N3CCOCC3)nc2)n1.Cc1nc2ccccc2n1-c1cncc(NC2Cc3ccccc3C2)n1.Cc1nc2ccccc2n1-c1cncc(Nc2nc3ccccc3s2)n1.FC(F)(F)c1ccc(Nc2cncc(-c3c(C4CC4)nc4ncccn34)n2)cc1
InChIInChI=1S/C21H18F3N5.C21H19F2N7O.C21H19N5.C20H15F3N6.C19H14N6S/c1-12-8-13(2)20-17(9-12)29(14(3)26-20)19-11-25-10-18(28-19)27-16-6-4-15(5-7-16)21(22,23)24;1-13-26-17-8-15(22)16(23)9-18(17)30(13)21-12-24-11-19(28-21)27-14-2-3-20(25-10-14)29-4-6-31-7-5-29;1-14-23-18-8-4-5-9-19(18)26(14)21-13-22-12-20(25-21)24-17-10-15-6-2-3-7-16(15)11-17;21-20(22,23)13-4-6-14(7-5-13)26-16-11-24-10-15(27-16)18-17(12-2-3-12)28-19-25-8-1-9-29(18)19;1-12-21-13-6-2-4-8-15(13)25(12)18-11-20-10-17(23-18)24-19-22-14-7-3-5-9-16(14)26-19/h4-11H,1-3H3,(H,27,28);2-3,8-12H,4-7H2,1H3,(H,27,28);2-9,12-13,17H,10-11H2,1H3,(H,24,25);1,4-12H,2-3H2,(H,26,27);2-11H,1H3,(H,22,23,24)
InChIKeyOIAJAKVAVIBCJI-UHFFFAOYSA-N
MW1917.05 g/mol
LogP21.89
Rot. Bonds17

About 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine

6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine (PubChem CID 159999874) has the molecular formula C102H85F8N29OS and a molecular weight of 1917.05 g/mol. Its IUPAC name is 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine.

Molecular Properties

Compound Name6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine
PubChem CID159999874
Molecular FormulaC102H85F8N29OS
Molecular Weight1917.05 g/mol
Exact Mass1915.71
IUPAC Name6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine
SMILESCc1cc(C)c2nc(C)n(-c3cncc(Nc4ccc(C(F)(F)F)cc4)n3)c2c1.Cc1nc2cc(F)c(F)cc2n1-c1cncc(Nc2ccc(N3CCOCC3)nc2)n1.Cc1nc2ccccc2n1-c1cncc(NC2Cc3ccccc3C2)n1.Cc1nc2ccccc2n1-c1cncc(Nc2nc3ccccc3s2)n1.FC(F)(F)c1ccc(Nc2cncc(-c3c(C4CC4)nc4ncccn34)n2)cc1
InChIInChI=1S/C21H18F3N5.C21H19F2N7O.C21H19N5.C20H15F3N6.C19H14N6S/c1-12-8-13(2)20-17(9-12)29(14(3)26-20)19-11-25-10-18(28-19)27-16-6-4-15(5-7-16)21(22,23)24;1-13-26-17-8-15(22)16(23)9-18(17)30(13)21-12-24-11-19(28-21)27-14-2-3-20(25-10-14)29-4-6-31-7-5-29;1-14-23-18-8-4-5-9-19(18)26(14)21-13-22-12-20(25-21)24-17-10-15-6-2-3-7-16(15)11-17;21-20(22,23)13-4-6-14(7-5-13)26-16-11-24-10-15(27-16)18-17(12-2-3-12)28-19-25-8-1-9-29(18)19;1-12-21-13-6-2-4-8-15(13)25(12)18-11-20-10-17(23-18)24-19-22-14-7-3-5-9-16(14)26-19/h4-11H,1-3H3,(H,27,28);2-3,8-12H,4-7H2,1H3,(H,27,28);2-9,12-13,17H,10-11H2,1H3,(H,24,25);1,4-12H,2-3H2,(H,26,27);2-11H,1H3,(H,22,23,24)
InChIKeyOIAJAKVAVIBCJI-UHFFFAOYSA-N
XLogP21.89
TPSA328.77 Ų
H-Bond Donors5
H-Bond Acceptors31
Rotatable Bonds17
Heavy Atoms141
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001917.05
LogP ≤ 521.89
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1031

Analyze 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine?
The IUPAC name of 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine (CID 159999874) is 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine.
What is the SMILES notation for 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine?
The canonical SMILES for 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine is Cc1cc(C)c2nc(C)n(-c3cncc(Nc4ccc(C(F)(F)F)cc4)n3)c2c1.Cc1nc2cc(F)c(F)cc2n1-c1cncc(Nc2ccc(N3CCOCC3)nc2)n1.Cc1nc2ccccc2n1-c1cncc(NC2Cc3ccccc3C2)n1.Cc1nc2ccccc2n1-c1cncc(Nc2nc3ccccc3s2)n1.FC(F)(F)c1ccc(Nc2cncc(-c3c(C4CC4)nc4ncccn34)n2)cc1.
What is the InChIKey of 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine?
The InChIKey is OIAJAKVAVIBCJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18F3N5.C21H19F2N7O.C21H19N5.C20H15F3N6.C19H14N6S/c1-12-8-13(2)20-17(9-12)29(14(3)26-20)19-11-25-10-18(28-19)27-16-6-4-15(5-7-16)21(22,23)24;1-13-26-17-8-15(22)16(23)9-18(17)30(13)21-12-24-11-19(28-21)27-14-2-3-20(25-10-14)29-4-6-31-7-5-29;1-14-23-18-8-4-5-9-19(18)26(14)21-13-22-12-20(25-21)24-17-10-15-6-2-3-7-16(15)11-17;21-20(22,23)13-4-6-14(7-5-13)26-16-11-24-10-15(27-16)18-17(12-2-3-12)28-19-25-8-1-9-29(18)19;1-12-21-13-6-2-4-8-15(13)25(12)18-11-20-10-17(23-18)24-19-22-14-7-3-5-9-16(14)26-19/h4-11H,1-3H3,(H,27,28);2-3,8-12H,4-7H2,1H3,(H,27,28);2-9,12-13,17H,10-11H2,1H3,(H,24,25);1,4-12H,2-3H2,(H,26,27);2-11H,1H3,(H,22,23,24).
What are the key properties of 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine?
6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine has a molecular weight of 1917.05 g/mol, XLogP of 21.89, 17 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopropylimidazo[1,2-a]pyrimidin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(5,6-difluoro-2-methylbenzimidazol-1-yl)-N-(6-morpholin-4-yl-3-pyridinyl)pyrazin-2-amine;N-(2,3-dihydro-1H-inden-2-yl)-6-(2-methylbenzimidazol-1-yl)pyrazin-2-amine;N-[6-(2-methylbenzimidazol-1-yl)pyrazin-2-yl]-1,3-benzothiazol-2-amine;N-[4-(trifluoromethyl)phenyl]-6-(2,4,6-trimethylbenzimidazol-1-yl)pyrazin-2-amine is sourced from PubChem (CID 159999874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).