6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol

C97H74Cl6FN25O8 — CID 159107212

IUPAC6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol
SMILESCc1cc(-c2nc(N)cnc2-c2cc(Cl)c(O)cn2)nc(C)n1.Cc1cc(F)cc(-c2nc(N)cnc2-c2cc(Cl)c(O)cn2)c1.Cc1ccoc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1coc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1.Nc1cnc(-c2cc(O)c3cc(Cl)[nH]c3c2)c(-c2ccccc2)n1.Nc1cnc(-c2ncc3cc(O)c(Cl)cc3n2)c(-c2ccccc2)n1
InChIInChI=1S/C18H12ClN5O.C18H13ClN4O.C16H12ClFN4O.C15H13ClN6O.2C15H12ClN3O2/c19-12-7-13-11(6-14(12)25)8-22-18(23-13)17-16(24-15(20)9-21-17)10-4-2-1-3-5-10;19-15-8-12-13(22-15)6-11(7-14(12)24)17-18(23-16(20)9-21-17)10-4-2-1-3-5-10;1-8-2-9(4-10(18)3-8)15-16(21-7-14(19)22-15)12-5-11(17)13(23)6-20-12;1-7-3-11(21-8(2)20-7)15-14(19-6-13(17)22-15)10-4-9(16)12(23)5-18-10;1-8-4-12(21-7-8)15-14(18-6-13(17)19-15)9-2-3-11(20)10(16)5-9;1-8-4-5-21-15(8)14-13(18-7-12(17)19-14)9-2-3-11(20)10(16)6-9/h1-9,25H,(H2,20,24);1-9,22,24H,(H2,20,23);2-7,23H,1H3,(H2,19,22);3-6,23H,1-2H3,(H2,17,22);2*2-7,20H,1H3,(H2,17,19)
InChIKeyKEAPEKRJGUPMMW-UHFFFAOYSA-N
MW1949.54 g/mol
LogP21.38
Rot. Bonds12

About 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol

6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol (PubChem CID 159107212) has the molecular formula C97H74Cl6FN25O8 and a molecular weight of 1949.54 g/mol. Its IUPAC name is 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol.

Molecular Properties

Compound Name6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol
PubChem CID159107212
Molecular FormulaC97H74Cl6FN25O8
Molecular Weight1949.54 g/mol
Exact Mass1945.43
IUPAC Name6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol
SMILESCc1cc(-c2nc(N)cnc2-c2cc(Cl)c(O)cn2)nc(C)n1.Cc1cc(F)cc(-c2nc(N)cnc2-c2cc(Cl)c(O)cn2)c1.Cc1ccoc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1coc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1.Nc1cnc(-c2cc(O)c3cc(Cl)[nH]c3c2)c(-c2ccccc2)n1.Nc1cnc(-c2ncc3cc(O)c(Cl)cc3n2)c(-c2ccccc2)n1
InChIInChI=1S/C18H12ClN5O.C18H13ClN4O.C16H12ClFN4O.C15H13ClN6O.2C15H12ClN3O2/c19-12-7-13-11(6-14(12)25)8-22-18(23-13)17-16(24-15(20)9-21-17)10-4-2-1-3-5-10;19-15-8-12-13(22-15)6-11(7-14(12)24)17-18(23-16(20)9-21-17)10-4-2-1-3-5-10;1-8-2-9(4-10(18)3-8)15-16(21-7-14(19)22-15)12-5-11(17)13(23)6-20-12;1-7-3-11(21-8(2)20-7)15-14(19-6-13(17)22-15)10-4-9(16)12(23)5-18-10;1-8-4-12(21-7-8)15-14(18-6-13(17)19-15)9-2-3-11(20)10(16)5-9;1-8-4-5-21-15(8)14-13(18-7-12(17)19-14)9-2-3-11(20)10(16)6-9/h1-9,25H,(H2,20,24);1-9,22,24H,(H2,20,23);2-7,23H,1H3,(H2,19,22);3-6,23H,1-2H3,(H2,17,22);2*2-7,20H,1H3,(H2,17,19)
InChIKeyKEAPEKRJGUPMMW-UHFFFAOYSA-N
XLogP21.38
TPSA551.59 Ų
H-Bond Donors13
H-Bond Acceptors32
Rotatable Bonds12
Heavy Atoms137
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001949.54
LogP ≤ 521.38
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1032

Analyze 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol?
The IUPAC name of 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol (CID 159107212) is 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol.
What is the SMILES notation for 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol?
The canonical SMILES for 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol is Cc1cc(-c2nc(N)cnc2-c2cc(Cl)c(O)cn2)nc(C)n1.Cc1cc(F)cc(-c2nc(N)cnc2-c2cc(Cl)c(O)cn2)c1.Cc1ccoc1-c1nc(N)cnc1-c1ccc(O)c(Cl)c1.Cc1coc(-c2nc(N)cnc2-c2ccc(O)c(Cl)c2)c1.Nc1cnc(-c2cc(O)c3cc(Cl)[nH]c3c2)c(-c2ccccc2)n1.Nc1cnc(-c2ncc3cc(O)c(Cl)cc3n2)c(-c2ccccc2)n1.
What is the InChIKey of 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol?
The InChIKey is KEAPEKRJGUPMMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClN5O.C18H13ClN4O.C16H12ClFN4O.C15H13ClN6O.2C15H12ClN3O2/c19-12-7-13-11(6-14(12)25)8-22-18(23-13)17-16(24-15(20)9-21-17)10-4-2-1-3-5-10;19-15-8-12-13(22-15)6-11(7-14(12)24)17-18(23-16(20)9-21-17)10-4-2-1-3-5-10;1-8-2-9(4-10(18)3-8)15-16(21-7-14(19)22-15)12-5-11(17)13(23)6-20-12;1-7-3-11(21-8(2)20-7)15-14(19-6-13(17)22-15)10-4-9(16)12(23)5-18-10;1-8-4-12(21-7-8)15-14(18-6-13(17)19-15)9-2-3-11(20)10(16)5-9;1-8-4-5-21-15(8)14-13(18-7-12(17)19-14)9-2-3-11(20)10(16)6-9/h1-9,25H,(H2,20,24);1-9,22,24H,(H2,20,23);2-7,23H,1H3,(H2,19,22);3-6,23H,1-2H3,(H2,17,22);2*2-7,20H,1H3,(H2,17,19).
What are the key properties of 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol?
6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol has a molecular weight of 1949.54 g/mol, XLogP of 21.38, 12 rotatable bonds, 13 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-amino-3-(2,6-dimethylpyrimidin-4-yl)pyrazin-2-yl]-4-chloropyridin-3-ol;6-[5-amino-3-(3-fluoro-5-methylphenyl)pyrazin-2-yl]-4-chloropyridin-3-ol;4-[5-amino-3-(3-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;4-[5-amino-3-(4-methylfuran-2-yl)pyrazin-2-yl]-2-chlorophenol;6-(5-amino-3-phenylpyrazin-2-yl)-2-chloro-1H-indol-4-ol;2-(5-amino-3-phenylpyrazin-2-yl)-7-chloroquinazolin-6-ol is sourced from PubChem (CID 159107212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).