N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide

C24H29N5O2 — CID 53164389

About N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide

N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide (PubChem CID 53164389) has the molecular formula C24H29N5O2 and a molecular weight of 419.53 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide.

Molecular Properties

• Compound Name: N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide
• PubChem CID: 53164389
• Molecular Formula: C24H29N5O2
• Molecular Weight: 419.53 g/mol
• Exact Mass: 419.23
• IUPAC Name: N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide
• SMILES: COc1cccc(CNC(=O)Cn2ccnc2-c2ccnc(N3CCC(C)CC3)c2)c1
• InChI: InChI=1S/C24H29N5O2/c1-18-7-11-28(12-8-18)22-15-20(6-9-25-22)24-26-10-13-29(24)17-23(30)27-16-19-4-3-5-21(14-19)31-2/h3-6,9-10,13-15,18H,7-8,11-12,16-17H2,1-2H3,(H,27,30)
• InChIKey: RHJBWNJLFJSWRI-UHFFFAOYSA-N
• XLogP: 3.51
• TPSA: 72.28 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	419.53
LogP ≤ 5	3.51
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide?

The IUPAC name of N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide (CID 53164389) is N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide.

What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide?

The canonical SMILES for N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide is COc1cccc(CNC(=O)Cn2ccnc2-c2ccnc(N3CCC(C)CC3)c2)c1.

What is the InChIKey of N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide?

The InChIKey is RHJBWNJLFJSWRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O2/c1-18-7-11-28(12-8-18)22-15-20(6-9-25-22)24-26-10-13-29(24)17-23(30)27-16-19-4-3-5-21(14-19)31-2/h3-6,9-10,13-15,18H,7-8,11-12,16-17H2,1-2H3,(H,27,30).

What are the key properties of N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide?

N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide has a molecular weight of 419.53 g/mol, XLogP of 3.51, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(3-methoxyphenyl)methyl]-2-[2-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]imidazol-1-yl]acetamide is sourced from PubChem (CID 53164389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).