6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine

C67H66ClN17O6 — CID 158165665

About 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine

6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine (PubChem CID 158165665) has the molecular formula C67H66ClN17O6 and a molecular weight of 1240.83 g/mol. Its IUPAC name is 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine.

Molecular Properties

• Compound Name: 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine
• PubChem CID: 158165665
• Molecular Formula: C67H66ClN17O6
• Molecular Weight: 1240.83 g/mol
• Exact Mass: 1239.51
• IUPAC Name: 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine
• SMILES: CC(C)Oc1cc2c(cn1)CN=C2c1ccnc(N2CCOCC2)c1.COc1ccc2c(n1)C(c1ccnc(N3CCOCC3)c1)=NC2.Clc1cc2c(cn1)CN=C2c1ccnc(-n2ccnc2)c1.O=c1ccc2c([nH]1)C(c1ccnc(N3CCOCC3)c1)=NC2
• InChI: InChI=1S/C19H22N4O2.C17H18N4O2.C16H16N4O2.C15H10ClN5/c1-13(2)25-18-10-16-15(11-21-18)12-22-19(16)14-3-4-20-17(9-14)23-5-7-24-8-6-23;1-22-15-3-2-13-11-19-16(17(13)20-15)12-4-5-18-14(10-12)21-6-8-23-9-7-21;21-14-2-1-12-10-18-15(16(12)19-14)11-3-4-17-13(9-11)20-5-7-22-8-6-20;16-13-6-12-11(7-19-13)8-20-15(12)10-1-2-18-14(5-10)21-4-3-17-9-21/h3-4,9-11,13H,5-8,12H2,1-2H3;2-5,10H,6-9,11H2,1H3;1-4,9H,5-8,10H2,(H,19,21);1-7,9H,8H2
• InChIKey: FWURJOYVSKPSFZ-UHFFFAOYSA-N
• XLogP: 7.75
• TPSA: 246.22 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 22
• Rotatable Bonds: 11
• Heavy Atoms: 91
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1240.83
LogP ≤ 5	7.75
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine?

The IUPAC name of 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine (CID 158165665) is 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine.

What is the SMILES notation for 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine?

The canonical SMILES for 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine is CC(C)Oc1cc2c(cn1)CN=C2c1ccnc(N2CCOCC2)c1.COc1ccc2c(n1)C(c1ccnc(N3CCOCC3)c1)=NC2.Clc1cc2c(cn1)CN=C2c1ccnc(-n2ccnc2)c1.O=c1ccc2c([nH]1)C(c1ccnc(N3CCOCC3)c1)=NC2.

What is the InChIKey of 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine?

The InChIKey is FWURJOYVSKPSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2.C17H18N4O2.C16H16N4O2.C15H10ClN5/c1-13(2)25-18-10-16-15(11-21-18)12-22-19(16)14-3-4-20-17(9-14)23-5-7-24-8-6-23;1-22-15-3-2-13-11-19-16(17(13)20-15)12-4-5-18-14(10-12)21-6-8-23-9-7-21;21-14-2-1-12-10-18-15(16(12)19-14)11-3-4-17-13(9-11)20-5-7-22-8-6-20;16-13-6-12-11(7-19-13)8-20-15(12)10-1-2-18-14(5-10)21-4-3-17-9-21/h3-4,9-11,13H,5-8,12H2,1-2H3;2-5,10H,6-9,11H2,1H3;1-4,9H,5-8,10H2,(H,19,21);1-7,9H,8H2.

What are the key properties of 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine?

6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine has a molecular weight of 1240.83 g/mol, XLogP of 7.75, 11 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-1-(2-imidazol-1-yl-4-pyridinyl)-3H-pyrrolo[3,4-c]pyridine;4-[4-(2-methoxy-5H-pyrrolo[3,4-b]pyridin-7-yl)-2-pyridinyl]morpholine;7-(2-morpholin-4-yl-4-pyridinyl)-1,5-dihydropyrrolo[3,4-b]pyridin-2-one;4-[4-(6-propan-2-yloxy-3H-pyrrolo[3,4-c]pyridin-1-yl)-2-pyridinyl]morpholine is sourced from PubChem (CID 158165665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).