1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine

C101H94N30O4 — CID 160515927

About 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine

1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine (PubChem CID 160515927) has the molecular formula C101H94N30O4 and a molecular weight of 1792.07 g/mol. Its IUPAC name is 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine.

Molecular Properties

• Compound Name: 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine
• PubChem CID: 160515927
• Molecular Formula: C101H94N30O4
• Molecular Weight: 1792.07 g/mol
• Exact Mass: 1790.81
• IUPAC Name: 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine
• SMILES: CN(C)c1cccc(-c2[nH]nc3ncc4c(c23)CCN(C(=O)Cc2ccccc2)C4)c1.COc1ccccc1-c1[nH]nc2ncc3c(c12)CCN(C(=O)Cc1ccccc1)C3.Cc1ccccc1-c1[nH]nc2ncc3c(c12)CCN(C(=O)Cc1ccccc1)C3.Nc1nc(N2CCc3c(cnc4[nH]ncc34)C2)c2cn[nH]c2n1.c1nc(N2CCc3c(cnc4[nH]ncc34)C2)c2cn[nH]c2n1
• InChI: InChI=1S/C25H25N5O.C24H22N4O2.C24H22N4O.C14H13N9.C14H12N8/c1-29(2)20-10-6-9-18(14-20)24-23-21-11-12-30(16-19(21)15-26-25(23)28-27-24)22(31)13-17-7-4-3-5-8-17;1-30-20-10-6-5-9-19(20)23-22-18-11-12-28(15-17(18)14-25-24(22)27-26-23)21(29)13-16-7-3-2-4-8-16;1-16-7-5-6-10-19(16)23-22-20-11-12-28(15-18(20)14-25-24(22)27-26-23)21(29)13-17-8-3-2-4-9-17;15-14-19-12-10(5-18-22-12)13(20-14)23-2-1-8-7(6-23)3-16-11-9(8)4-17-21-11;1-2-22(14-11-5-19-21-13(11)16-7-17-14)6-8-3-15-12-10(9(1)8)4-18-20-12/h3-10,14-15H,11-13,16H2,1-2H3,(H,26,27,28);2-10,14H,11-13,15H2,1H3,(H,25,26,27);2-10,14H,11-13,15H2,1H3,(H,25,26,27);3-5H,1-2,6H2,(H,16,17,21)(H3,15,18,19,20,22);3-5,7H,1-2,6H2,(H,15,18,20)(H,16,17,19,21)
• InChIKey: QTQRHZSYBCVNIM-UHFFFAOYSA-N
• XLogP: 13.60
• TPSA: 422.67 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 24
• Rotatable Bonds: 13
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1792.07
LogP ≤ 5	13.60
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine?

The IUPAC name of 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine (CID 160515927) is 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine.

What is the SMILES notation for 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine?

The canonical SMILES for 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine is CN(C)c1cccc(-c2[nH]nc3ncc4c(c23)CCN(C(=O)Cc2ccccc2)C4)c1.COc1ccccc1-c1[nH]nc2ncc3c(c12)CCN(C(=O)Cc1ccccc1)C3.Cc1ccccc1-c1[nH]nc2ncc3c(c12)CCN(C(=O)Cc1ccccc1)C3.Nc1nc(N2CCc3c(cnc4[nH]ncc34)C2)c2cn[nH]c2n1.c1nc(N2CCc3c(cnc4[nH]ncc34)C2)c2cn[nH]c2n1.

What is the InChIKey of 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine?

The InChIKey is QTQRHZSYBCVNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N5O.C24H22N4O2.C24H22N4O.C14H13N9.C14H12N8/c1-29(2)20-10-6-9-18(14-20)24-23-21-11-12-30(16-19(21)15-26-25(23)28-27-24)22(31)13-17-7-4-3-5-8-17;1-30-20-10-6-5-9-19(20)23-22-18-11-12-28(15-17(18)14-25-24(22)27-26-23)21(29)13-16-7-3-2-4-8-16;1-16-7-5-6-10-19(16)23-22-20-11-12-28(15-18(20)14-25-24(22)27-26-23)21(29)13-17-8-3-2-4-9-17;15-14-19-12-10(5-18-22-12)13(20-14)23-2-1-8-7(6-23)3-16-11-9(8)4-17-21-11;1-2-22(14-11-5-19-21-13(11)16-7-17-14)6-8-3-15-12-10(9(1)8)4-18-20-12/h3-10,14-15H,11-13,16H2,1-2H3,(H,26,27,28);2-10,14H,11-13,15H2,1H3,(H,25,26,27);2-10,14H,11-13,15H2,1H3,(H,25,26,27);3-5H,1-2,6H2,(H,16,17,21)(H3,15,18,19,20,22);3-5,7H,1-2,6H2,(H,15,18,20)(H,16,17,19,21).

What are the key properties of 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine?

1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine has a molecular weight of 1792.07 g/mol, XLogP of 13.60, 13 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[1-[3-(dimethylamino)phenyl]-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methoxyphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;1-[1-(2-methylphenyl)-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl]-2-phenylethanone;7-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)-3,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine;4-(3,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridin-7-yl)-1H-pyrazolo[5,4-d]pyrimidin-6-amine is sourced from PubChem (CID 160515927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).