6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one

C108H86Cl6N32O6 — CID 158929102

About 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one

6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one (PubChem CID 158929102) has the molecular formula C108H86Cl6N32O6 and a molecular weight of 2140.81 g/mol. Its IUPAC name is 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one.

Molecular Properties

• Compound Name: 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one
• PubChem CID: 158929102
• Molecular Formula: C108H86Cl6N32O6
• Molecular Weight: 2140.81 g/mol
• Exact Mass: 2136.55
• IUPAC Name: 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one
• SMILES: Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2[nH]c(C)cc2C)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2cc(C)c(C)[nH]2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2cn[nH]n2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2cnn(C)n2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2n[nH]c(C)n2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2nnc(C)n2C)cc(Cl)n1
• InChI: InChI=1S/2C20H17ClN4O.C18H15ClN6O.2C17H13ClN6O.C16H11ClN6O/c1-10-6-16(24-12(10)3)19-14(13-7-11(2)23-18(21)8-13)9-15-17(26)4-5-22-20(15)25-19;1-10-6-11(2)24-18(10)19-14(13-7-12(3)23-17(21)8-13)9-15-16(26)4-5-22-20(15)25-19;1-9-6-11(7-15(19)21-9)12-8-13-14(26)4-5-20-17(13)22-16(12)18-24-23-10(2)25(18)3;1-9-5-10(6-15(18)21-9)11-7-12-14(25)3-4-19-17(12)22-16(11)13-8-20-24(2)23-13;1-8-5-10(6-14(18)20-8)11-7-12-13(25)3-4-19-16(12)22-15(11)17-21-9(2)23-24-17;1-8-4-9(5-14(17)20-8)10-6-11-13(24)2-3-18-16(11)21-15(10)12-7-19-23-22-12/h2*4-9,24H,1-3H3,(H,22,25,26);4-8H,1-3H3,(H,20,22,26);3-8H,1-2H3,(H,19,22,25);3-7H,1-2H3,(H,19,22,25)(H,21,23,24);2-7H,1H3,(H,18,21,24)(H,19,22,23)
• InChIKey: JIUXYQAIZXARAY-UHFFFAOYSA-N
• XLogP: 20.68
• TPSA: 527.98 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 28
• Rotatable Bonds: 12
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2140.81
LogP ≤ 5	20.68
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one?

The IUPAC name of 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one (CID 158929102) is 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one.

What is the SMILES notation for 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one?

The canonical SMILES for 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one is Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2[nH]c(C)cc2C)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2cc(C)c(C)[nH]2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2cn[nH]n2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2cnn(C)n2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2n[nH]c(C)n2)cc(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2nnc(C)n2C)cc(Cl)n1.

What is the InChIKey of 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one?

The InChIKey is JIUXYQAIZXARAY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H17ClN4O.C18H15ClN6O.2C17H13ClN6O.C16H11ClN6O/c1-10-6-16(24-12(10)3)19-14(13-7-11(2)23-18(21)8-13)9-15-17(26)4-5-22-20(15)25-19;1-10-6-11(2)24-18(10)19-14(13-7-12(3)23-17(21)8-13)9-15-16(26)4-5-22-20(15)25-19;1-9-6-11(7-15(19)21-9)12-8-13-14(26)4-5-20-17(13)22-16(12)18-24-23-10(2)25(18)3;1-9-5-10(6-15(18)21-9)11-7-12-14(25)3-4-19-17(12)22-16(11)13-8-20-24(2)23-13;1-8-5-10(6-14(18)20-8)11-7-12-13(25)3-4-19-16(12)22-15(11)17-21-9(2)23-24-17;1-8-4-9(5-14(17)20-8)10-6-11-13(24)2-3-18-16(11)21-15(10)12-7-19-23-22-12/h2*4-9,24H,1-3H3,(H,22,25,26);4-8H,1-3H3,(H,20,22,26);3-8H,1-2H3,(H,19,22,25);3-7H,1-2H3,(H,19,22,25)(H,21,23,24);2-7H,1H3,(H,18,21,24)(H,19,22,23).

What are the key properties of 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one?

6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one has a molecular weight of 2140.81 g/mol, XLogP of 20.68, 12 rotatable bonds, 10 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(2-chloro-6-methyl-4-pyridinyl)-7-(3,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1H-pyrrol-2-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2-methyltriazol-4-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-(2H-triazol-4-yl)-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 158929102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).