5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine

C100H99N13O3 — CID 159198148

About 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine

5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 159198148) has the molecular formula C100H99N13O3 and a molecular weight of 1530.98 g/mol. Its IUPAC name is 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

• Compound Name: 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine
• PubChem CID: 159198148
• Molecular Formula: C100H99N13O3
• Molecular Weight: 1530.98 g/mol
• Exact Mass: 1529.80
• IUPAC Name: 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine
• SMILES: C1=C(c2ccc3[nH]c(-c4ccc(OCc5ccccc5)cc4)nc3n2)CCCC1.c1ccc(COc2ccc(-c3nc4nc(C5CCCCC5)ccc4[nH]3)cc2)cc1.c1ccc(NCc2ccc(-c3nc4ncc(C5CCCCC5)cc4[nH]3)cc2)cc1.c1ccc(OCc2ccc(-c3nc4ncc(C5CCCCC5)cc4[nH]3)cc2)cc1
• InChI: InChI=1S/C25H26N4.2C25H25N3O.C25H23N3O/c1-3-7-19(8-4-1)21-15-23-25(27-17-21)29-24(28-23)20-13-11-18(12-14-20)16-26-22-9-5-2-6-10-22;1-3-7-19(8-4-1)21-15-23-25(26-16-21)28-24(27-23)20-13-11-18(12-14-20)17-29-22-9-5-2-6-10-22;2*1-3-7-18(8-4-1)17-29-21-13-11-20(12-14-21)24-27-23-16-15-22(26-25(23)28-24)19-9-5-2-6-10-19/h2,5-6,9-15,17,19,26H,1,3-4,7-8,16H2,(H,27,28,29);2,5-6,9-16,19H,1,3-4,7-8,17H2,(H,26,27,28);1,3-4,7-8,11-16,19H,2,5-6,9-10,17H2,(H,26,27,28);1,3-4,7-9,11-16H,2,5-6,10,17H2,(H,26,27,28)
• InChIKey: KOXXEKQZWRPJKN-UHFFFAOYSA-N
• XLogP: 24.95
• TPSA: 206.00 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 12
• Rotatable Bonds: 20
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1530.98
LogP ≤ 5	24.95
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine?

The IUPAC name of 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine (CID 159198148) is 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine.

What is the SMILES notation for 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine?

The canonical SMILES for 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine is C1=C(c2ccc3[nH]c(-c4ccc(OCc5ccccc5)cc4)nc3n2)CCCC1.c1ccc(COc2ccc(-c3nc4nc(C5CCCCC5)ccc4[nH]3)cc2)cc1.c1ccc(NCc2ccc(-c3nc4ncc(C5CCCCC5)cc4[nH]3)cc2)cc1.c1ccc(OCc2ccc(-c3nc4ncc(C5CCCCC5)cc4[nH]3)cc2)cc1.

What is the InChIKey of 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine?

The InChIKey is KOXXEKQZWRPJKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4.2C25H25N3O.C25H23N3O/c1-3-7-19(8-4-1)21-15-23-25(27-17-21)29-24(28-23)20-13-11-18(12-14-20)16-26-22-9-5-2-6-10-22;1-3-7-19(8-4-1)21-15-23-25(26-16-21)28-24(27-23)20-13-11-18(12-14-20)17-29-22-9-5-2-6-10-22;2*1-3-7-18(8-4-1)17-29-21-13-11-20(12-14-21)24-27-23-16-15-22(26-25(23)28-24)19-9-5-2-6-10-19/h2,5-6,9-15,17,19,26H,1,3-4,7-8,16H2,(H,27,28,29);2,5-6,9-16,19H,1,3-4,7-8,17H2,(H,26,27,28);1,3-4,7-8,11-16,19H,2,5-6,9-10,17H2,(H,26,27,28);1,3-4,7-9,11-16H,2,5-6,10,17H2,(H,26,27,28).

What are the key properties of 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine?

5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 1530.98 g/mol, XLogP of 24.95, 20 rotatable bonds, 5 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(cyclohexen-1-yl)-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine;N-[[4-(6-cyclohexyl-1H-imidazo[4,5-b]pyridin-2-yl)phenyl]methyl]aniline;6-cyclohexyl-2-[4-(phenoxymethyl)phenyl]-1H-imidazo[4,5-b]pyridine;5-cyclohexyl-2-(4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 159198148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).