benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine

C121H96N32O4S5 — CID 159252866

About benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine

benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine (PubChem CID 159252866) has the molecular formula C121H96N32O4S5 and a molecular weight of 2222.65 g/mol. Its IUPAC name is benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine.

Molecular Properties

• Compound Name: benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine
• PubChem CID: 159252866
• Molecular Formula: C121H96N32O4S5
• Molecular Weight: 2222.65 g/mol
• Exact Mass: 2220.69
• IUPAC Name: benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine
• SMILES: Cn1ncc2ccccc21.c1cc2[nH]ccc2cn1.c1cc2nc[nH]c2cn1.c1cc2occc2cn1.c1cc2ocnc2cn1.c1cc2sccc2cn1.c1cc2scnc2cn1.c1ccc(-c2cscn2)cc1.c1ccc(-n2ncc3ccccc32)cc1.c1ccccc1.c1cnc2[nH]ccc2c1.c1cnc2nc[nH]c2c1.c1cnc2occc2c1.c1cnc2ocnc2c1.c1cnc2sccc2c1.c1cnc2scnc2c1.c1cnccn1.c1ncncn1
• InChI: InChI=1S/C13H10N2.C9H7NS.C8H8N2.2C7H6N2.2C7H5NO.2C7H5NS.2C6H5N3.2C6H4N2O.2C6H4N2S.C6H6.C4H4N2.C3H3N3/c1-2-7-12(8-3-1)15-13-9-5-4-6-11(13)10-14-15;1-2-4-8(5-3-1)9-6-11-7-10-9;1-10-8-5-3-2-4-7(8)6-9-10;1-4-9-7-2-3-8-5-6(1)7;1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-6-2-4-9-7(1)6;1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-6-2-4-9-7(1)6;1-2-6-3-5-9-7(6)8-4-1;1-2-7-3-6-5(1)8-4-9-6;1-2-5-6(7-3-1)9-4-8-5;1-2-7-3-5-6(1)9-4-8-5;1-2-5-6(7-3-1)9-4-8-5;1-2-7-3-5-6(1)9-4-8-5;1-2-5-6(7-3-1)9-4-8-5;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-4-2-6-3-5-1/h1-10H;1-7H;2-6H,1H3;1-5,9H;1-5H,(H,8,9);4*1-5H;1-4H,(H,8,9);1-4H,(H,7,8,9);4*1-4H;1-6H;1-4H;1-3H
• InChIKey: KVNGVEHGQXSLHL-UHFFFAOYSA-N
• XLogP: 28.56
• TPSA: 460.72 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 37
• Rotatable Bonds: 2
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2222.65
LogP ≤ 5	28.56
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine?

The IUPAC name of benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine (CID 159252866) is benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine.

What is the SMILES notation for benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine?

The canonical SMILES for benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine is Cn1ncc2ccccc21.c1cc2[nH]ccc2cn1.c1cc2nc[nH]c2cn1.c1cc2occc2cn1.c1cc2ocnc2cn1.c1cc2sccc2cn1.c1cc2scnc2cn1.c1ccc(-c2cscn2)cc1.c1ccc(-n2ncc3ccccc32)cc1.c1ccccc1.c1cnc2[nH]ccc2c1.c1cnc2nc[nH]c2c1.c1cnc2occc2c1.c1cnc2ocnc2c1.c1cnc2sccc2c1.c1cnc2scnc2c1.c1cnccn1.c1ncncn1.

What is the InChIKey of benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine?

The InChIKey is KVNGVEHGQXSLHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2.C9H7NS.C8H8N2.2C7H6N2.2C7H5NO.2C7H5NS.2C6H5N3.2C6H4N2O.2C6H4N2S.C6H6.C4H4N2.C3H3N3/c1-2-7-12(8-3-1)15-13-9-5-4-6-11(13)10-14-15;1-2-4-8(5-3-1)9-6-11-7-10-9;1-10-8-5-3-2-4-7(8)6-9-10;1-4-9-7-2-3-8-5-6(1)7;1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-6-2-4-9-7(1)6;1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-6-2-4-9-7(1)6;1-2-6-3-5-9-7(6)8-4-1;1-2-7-3-6-5(1)8-4-9-6;1-2-5-6(7-3-1)9-4-8-5;1-2-7-3-5-6(1)9-4-8-5;1-2-5-6(7-3-1)9-4-8-5;1-2-7-3-5-6(1)9-4-8-5;1-2-5-6(7-3-1)9-4-8-5;1-2-4-6-5-3-1;1-2-6-4-3-5-1;1-4-2-6-3-5-1/h1-10H;1-7H;2-6H,1H3;1-5,9H;1-5H,(H,8,9);4*1-5H;1-4H,(H,8,9);1-4H,(H,7,8,9);4*1-4H;1-6H;1-4H;1-3H.

What are the key properties of benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine?

benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine has a molecular weight of 2222.65 g/mol, XLogP of 28.56, 2 rotatable bonds, 4 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for benzene;furo[2,3-b]pyridine;furo[3,2-c]pyridine;1H-imidazo[4,5-b]pyridine;3H-imidazo[4,5-c]pyridine;1-methylindazole;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;1-phenylindazole;4-phenyl-1,3-thiazole;pyrazine;1H-pyrrolo[2,3-b]pyridine;1H-pyrrolo[3,2-c]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridine;thieno[2,3-b]pyridine;thieno[3,2-c]pyridine;1,3,5-triazine is sourced from PubChem (CID 159252866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).