N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol

C95H80Cl7N31O2 — CID 157486591

About N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol

N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol (PubChem CID 157486591) has the molecular formula C95H80Cl7N31O2 and a molecular weight of 1936.07 g/mol. Its IUPAC name is N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol.

Molecular Properties

• Compound Name: N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol
• PubChem CID: 157486591
• Molecular Formula: C95H80Cl7N31O2
• Molecular Weight: 1936.07 g/mol
• Exact Mass: 1931.49
• IUPAC Name: N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol
• SMILES: CNc1cccc(-c2c[nH]c3ncc(Cl)nc23)n1.COc1ccc(CNc2cccc(-c3c[nH]c4ncc(Cl)nc34)n2)cc1.Clc1cnc2[nH]cc(-c3cccc(N4CCNCC4)n3)c2n1.Clc1cnc2[nH]cc(-c3cccc(NCCc4ccccc4)n3)c2n1.Clc1cnc2[nH]cc(-c3cccc(Nc4ccccc4Cl)n3)c2n1.OCCNc1cccc(-c2c[nH]c3ncc(Cl)nc23)n1
• InChI: InChI=1S/C19H16ClN5O.C19H16ClN5.C17H11Cl2N5.C15H15ClN6.C13H12ClN5O.C12H10ClN5/c1-26-13-7-5-12(6-8-13)9-21-17-4-2-3-15(24-17)14-10-22-19-18(14)25-16(20)11-23-19;20-16-12-23-19-18(25-16)14(11-22-19)15-7-4-8-17(24-15)21-10-9-13-5-2-1-3-6-13;18-11-4-1-2-5-13(11)23-15-7-3-6-12(22-15)10-8-20-17-16(10)24-14(19)9-21-17;16-12-9-19-15-14(21-12)10(8-18-15)11-2-1-3-13(20-11)22-6-4-17-5-7-22;14-10-7-17-13-12(19-10)8(6-16-13)9-2-1-3-11(18-9)15-4-5-20;1-14-10-4-2-3-8(17-10)7-5-15-12-11(7)18-9(13)6-16-12/h2-8,10-11H,9H2,1H3,(H,21,24)(H,22,23);1-8,11-12H,9-10H2,(H,21,24)(H,22,23);1-9H,(H,20,21)(H,22,23);1-3,8-9,17H,4-7H2,(H,18,19);1-3,6-7,20H,4-5H2,(H,15,18)(H,16,17);2-6H,1H3,(H,14,17)(H,15,16)
• InChIKey: BWUBHRJPERZIST-UHFFFAOYSA-N
• XLogP: 20.57
• TPSA: 431.64 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 27
• Rotatable Bonds: 21
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1936.07
LogP ≤ 5	20.57
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol?

The IUPAC name of N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol (CID 157486591) is N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol.

What is the SMILES notation for N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol?

The canonical SMILES for N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol is CNc1cccc(-c2c[nH]c3ncc(Cl)nc23)n1.COc1ccc(CNc2cccc(-c3c[nH]c4ncc(Cl)nc34)n2)cc1.Clc1cnc2[nH]cc(-c3cccc(N4CCNCC4)n3)c2n1.Clc1cnc2[nH]cc(-c3cccc(NCCc4ccccc4)n3)c2n1.Clc1cnc2[nH]cc(-c3cccc(Nc4ccccc4Cl)n3)c2n1.OCCNc1cccc(-c2c[nH]c3ncc(Cl)nc23)n1.

What is the InChIKey of N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol?

The InChIKey is BWUBHRJPERZIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN5O.C19H16ClN5.C17H11Cl2N5.C15H15ClN6.C13H12ClN5O.C12H10ClN5/c1-26-13-7-5-12(6-8-13)9-21-17-4-2-3-15(24-17)14-10-22-19-18(14)25-16(20)11-23-19;20-16-12-23-19-18(25-16)14(11-22-19)15-7-4-8-17(24-15)21-10-9-13-5-2-1-3-6-13;18-11-4-1-2-5-13(11)23-15-7-3-6-12(22-15)10-8-20-17-16(10)24-14(19)9-21-17;16-12-9-19-15-14(21-12)10(8-18-15)11-2-1-3-13(20-11)22-6-4-17-5-7-22;14-10-7-17-13-12(19-10)8(6-16-13)9-2-1-3-11(18-9)15-4-5-20;1-14-10-4-2-3-8(17-10)7-5-15-12-11(7)18-9(13)6-16-12/h2-8,10-11H,9H2,1H3,(H,21,24)(H,22,23);1-8,11-12H,9-10H2,(H,21,24)(H,22,23);1-9H,(H,20,21)(H,22,23);1-3,8-9,17H,4-7H2,(H,18,19);1-3,6-7,20H,4-5H2,(H,15,18)(H,16,17);2-6H,1H3,(H,14,17)(H,15,16).

What are the key properties of N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol?

N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol has a molecular weight of 1936.07 g/mol, XLogP of 20.57, 21 rotatable bonds, 13 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-chlorophenyl)-6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)pyridin-2-amine;2-chloro-7-(6-piperazin-1-yl-2-pyridinyl)-5H-pyrrolo[2,3-b]pyrazine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(4-methoxyphenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-methylpyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-(2-phenylethyl)pyridin-2-amine;2-[[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]amino]ethanol is sourced from PubChem (CID 157486591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).