1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine

C89H86Cl3FN12O5 — CID 158129079

About 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine

1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine (PubChem CID 158129079) has the molecular formula C89H86Cl3FN12O5 and a molecular weight of 1529.10 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine.

Molecular Properties

• Compound Name: 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine
• PubChem CID: 158129079
• Molecular Formula: C89H86Cl3FN12O5
• Molecular Weight: 1529.10 g/mol
• Exact Mass: 1526.59
• IUPAC Name: 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine
• SMILES: Cc1ccc(-n2cc(C3CCOCC3)c3ccncc32)cc1.Clc1ccc(-n2cc(C3CCOCC3)c3ccncc32)cc1.Clc1ccc(-n2cc(C3CCOCC3)c3ccncc32)nc1.Clc1ccc(-n2cc(N3CCOCC3)c3ccncc32)cc1.Fc1ccc(-n2cc(C3CCOCC3)c3ccncc32)cc1
• InChI: InChI=1S/C19H20N2O.C18H17ClN2O.C18H17FN2O.2C17H16ClN3O/c1-14-2-4-16(5-3-14)21-13-18(15-7-10-22-11-8-15)17-6-9-20-12-19(17)21;2*19-14-1-3-15(4-2-14)21-12-17(13-6-9-22-10-7-13)16-5-8-20-11-18(16)21;18-13-1-3-14(4-2-13)21-12-17(20-7-9-22-10-8-20)15-5-6-19-11-16(15)21;18-13-1-2-17(20-9-13)21-11-15(12-4-7-22-8-5-12)14-3-6-19-10-16(14)21/h2-6,9,12-13,15H,7-8,10-11H2,1H3;2*1-5,8,11-13H,6-7,9-10H2;1-6,11-12H,7-10H2;1-3,6,9-12H,4-5,7-8H2
• InChIKey: FSNVMVNGUHXMDN-UHFFFAOYSA-N
• XLogP: 20.34
• TPSA: 151.38 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 10
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1529.10
LogP ≤ 5	20.34
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine?

The IUPAC name of 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine (CID 158129079) is 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine.

What is the SMILES notation for 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine?

The canonical SMILES for 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine is Cc1ccc(-n2cc(C3CCOCC3)c3ccncc32)cc1.Clc1ccc(-n2cc(C3CCOCC3)c3ccncc32)cc1.Clc1ccc(-n2cc(C3CCOCC3)c3ccncc32)nc1.Clc1ccc(-n2cc(N3CCOCC3)c3ccncc32)cc1.Fc1ccc(-n2cc(C3CCOCC3)c3ccncc32)cc1.

What is the InChIKey of 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine?

The InChIKey is FSNVMVNGUHXMDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O.C18H17ClN2O.C18H17FN2O.2C17H16ClN3O/c1-14-2-4-16(5-3-14)21-13-18(15-7-10-22-11-8-15)17-6-9-20-12-19(17)21;2*19-14-1-3-15(4-2-14)21-12-17(13-6-9-22-10-7-13)16-5-8-20-11-18(16)21;18-13-1-3-14(4-2-13)21-12-17(20-7-9-22-10-8-20)15-5-6-19-11-16(15)21;18-13-1-2-17(20-9-13)21-11-15(12-4-7-22-8-5-12)14-3-6-19-10-16(14)21/h2-6,9,12-13,15H,7-8,10-11H2,1H3;2*1-5,8,11-13H,6-7,9-10H2;1-6,11-12H,7-10H2;1-3,6,9-12H,4-5,7-8H2.

What are the key properties of 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine?

1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine has a molecular weight of 1529.10 g/mol, XLogP of 20.34, 10 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-chlorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]morpholine;1-(5-chloro-2-pyridinyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine;1-(4-methylphenyl)-3-(oxan-4-yl)pyrrolo[2,3-c]pyridine is sourced from PubChem (CID 158129079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).