10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine

C47H44N20O2 — CID 157210730

About 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine

10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine (PubChem CID 157210730) has the molecular formula C47H44N20O2 and a molecular weight of 921.01 g/mol. Its IUPAC name is 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine.

Molecular Properties

• Compound Name: 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine
• PubChem CID: 157210730
• Molecular Formula: C47H44N20O2
• Molecular Weight: 921.01 g/mol
• Exact Mass: 920.40
• IUPAC Name: 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine
• SMILES: CCCn1ncc2c1nc(N)n1nc(-c3ccco3)nc21.Nc1nc2c(cnn2CCN2CCc3nc4ccncc4cc3C2)c2nc(-c3ccco3)nn12.c1cc2nc3c(cc2cn1)CNCC3
• InChI: InChI=1S/C23H20N10O.C13H13N7O.C11H11N3/c24-23-29-21-16(22-28-20(30-33(22)23)19-2-1-9-34-19)12-26-32(21)8-7-31-6-4-18-15(13-31)10-14-11-25-5-3-17(14)27-18;1-2-5-19-11-8(7-15-19)12-16-10(9-4-3-6-21-9)18-20(12)13(14)17-11;1-3-12-6-8-5-9-7-13-4-2-11(9)14-10(1)8/h1-3,5,9-12H,4,6-8,13H2,(H2,24,29);3-4,6-7H,2,5H2,1H3,(H2,14,17);1,3,5-6,13H,2,4,7H2
• InChIKey: ARWBZDAXAGGLLT-UHFFFAOYSA-N
• XLogP: 5.32
• TPSA: 266.95 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 22
• Rotatable Bonds: 7
• Heavy Atoms: 69
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	921.01
LogP ≤ 5	5.32
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine?

The IUPAC name of 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine (CID 157210730) is 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine.

What is the SMILES notation for 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine?

The canonical SMILES for 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine is CCCn1ncc2c1nc(N)n1nc(-c3ccco3)nc21.Nc1nc2c(cnn2CCN2CCc3nc4ccncc4cc3C2)c2nc(-c3ccco3)nn12.c1cc2nc3c(cc2cn1)CNCC3.

What is the InChIKey of 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine?

The InChIKey is ARWBZDAXAGGLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N10O.C13H13N7O.C11H11N3/c24-23-29-21-16(22-28-20(30-33(22)23)19-2-1-9-34-19)12-26-32(21)8-7-31-6-4-18-15(13-31)10-14-11-25-5-3-17(14)27-18;1-2-5-19-11-8(7-15-19)12-16-10(9-4-3-6-21-9)18-20(12)13(14)17-11;1-3-12-6-8-5-9-7-13-4-2-11(9)14-10(1)8/h1-3,5,9-12H,4,6-8,13H2,(H2,24,29);3-4,6-7H,2,5H2,1H3,(H2,14,17);1,3,5-6,13H,2,4,7H2.

What are the key properties of 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine?

10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine has a molecular weight of 921.01 g/mol, XLogP of 5.32, 7 rotatable bonds, 3 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[2-(3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridin-2-yl)ethyl]-4-(furan-2-yl)-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;4-(furan-2-yl)-10-propyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-7-amine;6,7,8,9-tetrahydropyrido[4,3-b][1,6]naphthyridine is sourced from PubChem (CID 157210730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).