N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide

C65H69N11O3 — CID 87089560

About N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide

N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide (PubChem CID 87089560) has the molecular formula C65H69N11O3 and a molecular weight of 1052.34 g/mol. Its IUPAC name is N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide.

Molecular Properties

• Compound Name: N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide
• PubChem CID: 87089560
• Molecular Formula: C65H69N11O3
• Molecular Weight: 1052.34 g/mol
• Exact Mass: 1051.56
• IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide
• SMILES: CCc1c(-c2cn(-c3cc(C(=O)Nc4cc(C(C)(C)C)ccc4OC)ccc3C)cn2)cnn1-c1ccccc1.CCc1c(-c2cn(-c3cc(C(=O)Nc4cc(C(C)(C)C)cnc4C)ccc3C)cn2)cnn1-c1ccccc1
• InChI: InChI=1S/C33H35N5O2.C32H34N6O/c1-7-29-26(19-35-38(29)25-11-9-8-10-12-25)28-20-37(21-34-28)30-17-23(14-13-22(30)2)32(39)36-27-18-24(33(3,4)5)15-16-31(27)40-6;1-7-29-26(18-35-38(29)25-11-9-8-10-12-25)28-19-37(20-34-28)30-15-23(14-13-21(30)2)31(39)36-27-16-24(32(4,5)6)17-33-22(27)3/h8-21H,7H2,1-6H3,(H,36,39);8-20H,7H2,1-6H3,(H,36,39)
• InChIKey: FTVFPWLJUXEAQK-UHFFFAOYSA-N
• XLogP: 14.00
• TPSA: 151.60 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 12
• Rotatable Bonds: 13
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1052.34
LogP ≤ 5	14.00
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide?

The IUPAC name of N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide (CID 87089560) is N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide.

What is the SMILES notation for N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide?

The canonical SMILES for N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide is CCc1c(-c2cn(-c3cc(C(=O)Nc4cc(C(C)(C)C)ccc4OC)ccc3C)cn2)cnn1-c1ccccc1.CCc1c(-c2cn(-c3cc(C(=O)Nc4cc(C(C)(C)C)cnc4C)ccc3C)cn2)cnn1-c1ccccc1.

What is the InChIKey of N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide?

The InChIKey is FTVFPWLJUXEAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H35N5O2.C32H34N6O/c1-7-29-26(19-35-38(29)25-11-9-8-10-12-25)28-20-37(21-34-28)30-17-23(14-13-22(30)2)32(39)36-27-18-24(33(3,4)5)15-16-31(27)40-6;1-7-29-26(18-35-38(29)25-11-9-8-10-12-25)28-19-37(20-34-28)30-15-23(14-13-21(30)2)31(39)36-27-16-24(32(4,5)6)17-33-22(27)3/h8-21H,7H2,1-6H3,(H,36,39);8-20H,7H2,1-6H3,(H,36,39).

What are the key properties of N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide?

N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide has a molecular weight of 1052.34 g/mol, XLogP of 14.00, 13 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-tert-butyl-2-methoxyphenyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide;N-(5-tert-butyl-2-methyl-3-pyridinyl)-3-[4-(5-ethyl-1-phenylpyrazol-4-yl)imidazol-1-yl]-4-methylbenzamide is sourced from PubChem (CID 87089560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).