methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline

C108H100N26O11S — CID 158583415

About methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline

methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline (PubChem CID 158583415) has the molecular formula C108H100N26O11S and a molecular weight of 1970.23 g/mol. Its IUPAC name is methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline.

Molecular Properties

• Compound Name: methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline
• PubChem CID: 158583415
• Molecular Formula: C108H100N26O11S
• Molecular Weight: 1970.23 g/mol
• Exact Mass: 1968.78
• IUPAC Name: methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline
• SMILES: C.C.C.C.C.COc1ccc2c(OCc3nnc4ccc(-c5cccnc5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(-c5ccsc5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(-c5cnccn5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(-c5ncccn5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(C(N)=O)cn34)ccnc2c1
• InChI: InChI=1S/C22H17N5O2.2C21H16N6O2.C21H16N4O2S.C18H15N5O3.5CH4/c1-28-17-5-6-18-19(11-17)24-10-8-20(18)29-14-22-26-25-21-7-4-16(13-27(21)22)15-3-2-9-23-12-15;1-28-15-4-5-16-17(11-15)22-10-7-18(16)29-13-20-26-25-19-6-3-14(12-27(19)20)21-23-8-2-9-24-21;1-28-15-3-4-16-17(10-15)23-7-6-19(16)29-13-21-26-25-20-5-2-14(12-27(20)21)18-11-22-8-9-24-18;1-26-16-3-4-17-18(10-16)22-8-6-19(17)27-12-21-24-23-20-5-2-14(11-25(20)21)15-7-9-28-13-15;1-25-12-3-4-13-14(8-12)20-7-6-15(13)26-10-17-22-21-16-5-2-11(18(19)24)9-23(16)17;;;;;/h2-13H,14H2,1H3;2*2-12H,13H2,1H3;2-11,13H,12H2,1H3;2-9H,10H2,1H3,(H2,19,24);5*1H4
• InChIKey: HTNKBNZDLONRJL-UHFFFAOYSA-N
• XLogP: 20.31
• TPSA: 415.24 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 37
• Rotatable Bonds: 25
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1970.23
LogP ≤ 5	20.31
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline?

The IUPAC name of methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline (CID 158583415) is methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline.

What is the SMILES notation for methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline?

The canonical SMILES for methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline is C.C.C.C.C.COc1ccc2c(OCc3nnc4ccc(-c5cccnc5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(-c5ccsc5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(-c5cnccn5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(-c5ncccn5)cn34)ccnc2c1.COc1ccc2c(OCc3nnc4ccc(C(N)=O)cn34)ccnc2c1.

What is the InChIKey of methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline?

The InChIKey is HTNKBNZDLONRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5O2.2C21H16N6O2.C21H16N4O2S.C18H15N5O3.5CH4/c1-28-17-5-6-18-19(11-17)24-10-8-20(18)29-14-22-26-25-21-7-4-16(13-27(21)22)15-3-2-9-23-12-15;1-28-15-4-5-16-17(11-15)22-10-7-18(16)29-13-20-26-25-19-6-3-14(12-27(19)20)21-23-8-2-9-24-21;1-28-15-3-4-16-17(10-15)23-7-6-19(16)29-13-21-26-25-20-5-2-14(12-27(20)21)18-11-22-8-9-24-18;1-26-16-3-4-17-18(10-16)22-8-6-19(17)27-12-21-24-23-20-5-2-14(11-25(20)21)15-7-9-28-13-15;1-25-12-3-4-13-14(8-12)20-7-6-15(13)26-10-17-22-21-16-5-2-11(18(19)24)9-23(16)17;;;;;/h2-13H,14H2,1H3;2*2-12H,13H2,1H3;2-11,13H,12H2,1H3;2-9H,10H2,1H3,(H2,19,24);5*1H4.

What are the key properties of methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline?

methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline has a molecular weight of 1970.23 g/mol, XLogP of 20.31, 25 rotatable bonds, 1 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for methane;7-methoxy-4-[(6-pyrazin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyridin-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;7-methoxy-4-[(6-pyrimidin-2-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline;3-[(7-methoxyquinolin-4-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;7-methoxy-4-[(6-thiophen-3-yl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methoxy]quinoline is sourced from PubChem (CID 158583415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).