bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one

C121H134N18O9 — CID 158022807

About bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one

bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one (PubChem CID 158022807) has the molecular formula C121H134N18O9 and a molecular weight of 1984.52 g/mol. Its IUPAC name is bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one.

Molecular Properties

• Compound Name: bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one
• PubChem CID: 158022807
• Molecular Formula: C121H134N18O9
• Molecular Weight: 1984.52 g/mol
• Exact Mass: 1983.06
• IUPAC Name: bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one
• SMILES: CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N(C)C)c3)cc21.CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N(C)C)c3)cc21.CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N(C)C)n3)cc21.CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N4CC(O)C4)c3)cc21.CCC1=C(C)Cc2ncc(-c3cccc(N4CCOCC4=O)c3)cc21.CCC1=C(C)Cc2ncc(-c3cccc(N4CCOCC4=O)n3)cc21
• InChI: InChI=1S/C21H23N3O2.C21H22N2O2.C20H21N3O2.2C20H23N3O.C19H22N4O/c1-3-16-12(2)6-20-17(16)8-14(9-23-20)13-4-5-19(22)18(7-13)21(26)24-10-15(25)11-24;1-3-18-14(2)9-20-19(18)11-16(12-22-20)15-5-4-6-17(10-15)23-7-8-25-13-21(23)24;1-3-15-13(2)9-18-16(15)10-14(11-21-18)17-5-4-6-19(22-17)23-7-8-25-12-20(23)24;2*1-5-15-12(2)8-19-16(15)10-14(11-22-19)13-6-7-18(21)17(9-13)20(24)23(3)4;1-5-13-11(2)8-17-14(13)9-12(10-21-17)16-7-6-15(20)18(22-16)19(24)23(3)4/h4-5,7-9,15,25H,3,6,10-11,22H2,1-2H3;4-6,10-12H,3,7-9,13H2,1-2H3;4-6,10-11H,3,7-9,12H2,1-2H3;2*6-7,9-11H,5,8,21H2,1-4H3;6-7,9-10H,5,8,20H2,1-4H3
• InChIKey: FGGIBEFYTIEWOQ-UHFFFAOYSA-N
• XLogP: 20.70
• TPSA: 367.75 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 21
• Rotatable Bonds: 18
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1984.52
LogP ≤ 5	20.70
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one?

The IUPAC name of bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one (CID 158022807) is bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one.

What is the SMILES notation for bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one?

The canonical SMILES for bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one is CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N(C)C)c3)cc21.CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N(C)C)c3)cc21.CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N(C)C)n3)cc21.CCC1=C(C)Cc2ncc(-c3ccc(N)c(C(=O)N4CC(O)C4)c3)cc21.CCC1=C(C)Cc2ncc(-c3cccc(N4CCOCC4=O)c3)cc21.CCC1=C(C)Cc2ncc(-c3cccc(N4CCOCC4=O)n3)cc21.

What is the InChIKey of bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one?

The InChIKey is FGGIBEFYTIEWOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2.C21H22N2O2.C20H21N3O2.2C20H23N3O.C19H22N4O/c1-3-16-12(2)6-20-17(16)8-14(9-23-20)13-4-5-19(22)18(7-13)21(26)24-10-15(25)11-24;1-3-18-14(2)9-20-19(18)11-16(12-22-20)15-5-4-6-17(10-15)23-7-8-25-13-21(23)24;1-3-15-13(2)9-18-16(15)10-14(11-21-18)17-5-4-6-19(22-17)23-7-8-25-12-20(23)24;2*1-5-15-12(2)8-19-16(15)10-14(11-22-19)13-6-7-18(21)17(9-13)20(24)23(3)4;1-5-13-11(2)8-17-14(13)9-12(10-21-17)16-7-6-15(20)18(22-16)19(24)23(3)4/h4-5,7-9,15,25H,3,6,10-11,22H2,1-2H3;4-6,10-12H,3,7-9,13H2,1-2H3;4-6,10-11H,3,7-9,12H2,1-2H3;2*6-7,9-11H,5,8,21H2,1-4H3;6-7,9-10H,5,8,20H2,1-4H3.

What are the key properties of bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one?

bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one has a molecular weight of 1984.52 g/mol, XLogP of 20.70, 18 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylbenzamide);3-amino-6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-N,N-dimethylpyridine-2-carboxamide;[2-amino-5-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]-(3-hydroxyazetidin-1-yl)methanone;4-[3-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)phenyl]morpholin-3-one;4-[6-(5-ethyl-6-methyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]morpholin-3-one is sourced from PubChem (CID 158022807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).