6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine

C136H174ClI2N45O4 — CID 158304569

IUPAC6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine
SMILESCC1CCN(c2cnc3c(I)nn(C4CCCCO4)c3n2)[C@H](C)C1.CC1CCN(c2cnc3c(N4CCCc5ncccc54)nn(C4CCCCO4)c3n2)[C@H](C)C1.C[C@@H]1CC(N)CCN1c1cnc2c(N3CCCc4ncccc43)nn(C3CCCCO3)c2n1.C[C@@H]1CC(N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.C[C@@H]1C[C@@H](N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.C[C@H]1C[C@H](N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.Clc1cnc2c(I)nn(C3CCCCO3)c2n1
InChIInChI=1S/C25H33N7O.C24H32N8O.3C20H25N7.C17H24IN5O.C10H10ClIN4O/c1-17-10-13-30(18(2)15-17)21-16-27-23-24(28-21)32(22-9-3-4-14-33-22)29-25(23)31-12-6-7-19-20(31)8-5-11-26-19;1-16-14-17(25)9-12-30(16)20-15-27-22-23(28-20)32(21-8-2-3-13-33-21)29-24(22)31-11-5-6-18-19(31)7-4-10-26-18;3*1-13-10-14(21)6-9-26(13)18-12-23-19-16(25-18)11-24-20(19)27-8-3-4-15-17(27)5-2-7-22-15;1-11-6-7-22(12(2)9-11)13-10-19-15-16(18)21-23(17(15)20-13)14-5-3-4-8-24-14;11-6-5-13-8-9(12)15-16(10(8)14-6)7-3-1-2-4-17-7/h5,8,11,16-18,22H,3-4,6-7,9-10,12-15H2,1-2H3;4,7,10,15-17,21H,2-3,5-6,8-9,11-14,25H2,1H3;3*2,5,7,12-14H,3-4,6,8-11,21H2,1H3;10-12,14H,3-9H2,1-2H3;5,7H,1-4H2/t17?,18-,22?;16-,17?,21?;13-,14?;2*13-,14+;11?,12-,14?;/m111101./s1
InChIKeyGMXOGIAXJMTOMF-MHUSXTJASA-N
MW2792.46 g/mol
LogP20.19
Rot. Bonds12

About 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine

6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine (PubChem CID 158304569) has the molecular formula C136H174ClI2N45O4 and a molecular weight of 2792.46 g/mol. Its IUPAC name is 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine.

Molecular Properties

Compound Name6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine
PubChem CID158304569
Molecular FormulaC136H174ClI2N45O4
Molecular Weight2792.46 g/mol
Exact Mass2790.26
IUPAC Name6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine
SMILESCC1CCN(c2cnc3c(I)nn(C4CCCCO4)c3n2)[C@H](C)C1.CC1CCN(c2cnc3c(N4CCCc5ncccc54)nn(C4CCCCO4)c3n2)[C@H](C)C1.C[C@@H]1CC(N)CCN1c1cnc2c(N3CCCc4ncccc43)nn(C3CCCCO3)c2n1.C[C@@H]1CC(N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.C[C@@H]1C[C@@H](N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.C[C@H]1C[C@H](N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.Clc1cnc2c(I)nn(C3CCCCO3)c2n1
InChIInChI=1S/C25H33N7O.C24H32N8O.3C20H25N7.C17H24IN5O.C10H10ClIN4O/c1-17-10-13-30(18(2)15-17)21-16-27-23-24(28-21)32(22-9-3-4-14-33-22)29-25(23)31-12-6-7-19-20(31)8-5-11-26-19;1-16-14-17(25)9-12-30(16)20-15-27-22-23(28-20)32(21-8-2-3-13-33-21)29-24(22)31-11-5-6-18-19(31)7-4-10-26-18;3*1-13-10-14(21)6-9-26(13)18-12-23-19-16(25-18)11-24-20(19)27-8-3-4-15-17(27)5-2-7-22-15;1-11-6-7-22(12(2)9-11)13-10-19-15-16(18)21-23(17(15)20-13)14-5-3-4-8-24-14;11-6-5-13-8-9(12)15-16(10(8)14-6)7-3-1-2-4-17-7/h5,8,11,16-18,22H,3-4,6-7,9-10,12-15H2,1-2H3;4,7,10,15-17,21H,2-3,5-6,8-9,11-14,25H2,1H3;3*2,5,7,12-14H,3-4,6,8-11,21H2,1H3;10-12,14H,3-9H2,1-2H3;5,7H,1-4H2/t17?,18-,22?;16-,17?,21?;13-,14?;2*13-,14+;11?,12-,14?;/m111101./s1
InChIKeyGMXOGIAXJMTOMF-MHUSXTJASA-N
XLogP20.19
TPSA529.91 Ų
H-Bond Donors4
H-Bond Acceptors49
Rotatable Bonds12
Heavy Atoms188
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002792.46
LogP ≤ 520.19
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1049

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine?
The IUPAC name of 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine (CID 158304569) is 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine.
What is the SMILES notation for 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine?
The canonical SMILES for 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine is CC1CCN(c2cnc3c(I)nn(C4CCCCO4)c3n2)[C@H](C)C1.CC1CCN(c2cnc3c(N4CCCc5ncccc54)nn(C4CCCCO4)c3n2)[C@H](C)C1.C[C@@H]1CC(N)CCN1c1cnc2c(N3CCCc4ncccc43)nn(C3CCCCO3)c2n1.C[C@@H]1CC(N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.C[C@@H]1C[C@@H](N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.C[C@H]1C[C@H](N)CCN1c1cnc2c(n1)CN=C2N1CCCc2ncccc21.Clc1cnc2c(I)nn(C3CCCCO3)c2n1.
What is the InChIKey of 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine?
The InChIKey is GMXOGIAXJMTOMF-MHUSXTJASA-N. The full InChI is InChI=1S/C25H33N7O.C24H32N8O.3C20H25N7.C17H24IN5O.C10H10ClIN4O/c1-17-10-13-30(18(2)15-17)21-16-27-23-24(28-21)32(22-9-3-4-14-33-22)29-25(23)31-12-6-7-19-20(31)8-5-11-26-19;1-16-14-17(25)9-12-30(16)20-15-27-22-23(28-20)32(21-8-2-3-13-33-21)29-24(22)31-11-5-6-18-19(31)7-4-10-26-18;3*1-13-10-14(21)6-9-26(13)18-12-23-19-16(25-18)11-24-20(19)27-8-3-4-15-17(27)5-2-7-22-15;1-11-6-7-22(12(2)9-11)13-10-19-15-16(18)21-23(17(15)20-13)14-5-3-4-8-24-14;11-6-5-13-8-9(12)15-16(10(8)14-6)7-3-1-2-4-17-7/h5,8,11,16-18,22H,3-4,6-7,9-10,12-15H2,1-2H3;4,7,10,15-17,21H,2-3,5-6,8-9,11-14,25H2,1H3;3*2,5,7,12-14H,3-4,6,8-11,21H2,1H3;10-12,14H,3-9H2,1-2H3;5,7H,1-4H2/t17?,18-,22?;16-,17?,21?;13-,14?;2*13-,14+;11?,12-,14?;/m111101./s1.
What are the key properties of 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine?
6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine has a molecular weight of 2792.46 g/mol, XLogP of 20.19, 12 rotatable bonds, 4 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;(2R)-1-[3-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-2-methylpiperidin-4-amine;(2R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2R,4S)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;(2S,4R)-1-[7-(3,4-dihydro-2H-1,5-naphthyridin-1-yl)-5H-pyrrolo[3,4-b]pyrazin-3-yl]-2-methylpiperidin-4-amine;6-[(2R)-2,4-dimethylpiperidin-1-yl]-3-iodo-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazine;1-[6-[(2R)-2,4-dimethylpiperidin-1-yl]-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-3-yl]-3,4-dihydro-2H-1,5-naphthyridine is sourced from PubChem (CID 158304569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).