2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide

C22H23N3O3 — CID 113012370

IUPAC2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(NCc3ccccc3OC)nc2)cc1
InChIInChI=1S/C22H23N3O3/c1-27-19-10-7-16(8-11-19)13-22(26)25-18-9-12-21(24-15-18)23-14-17-5-3-4-6-20(17)28-2/h3-12,15H,13-14H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyZHCNZQBZTZQOFE-UHFFFAOYSA-N
MW377.44 g/mol
LogP3.89
Rot. Bonds8

About 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide

2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide (PubChem CID 113012370) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide
PubChem CID113012370
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC Name2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(NCc3ccccc3OC)nc2)cc1
InChIInChI=1S/C22H23N3O3/c1-27-19-10-7-16(8-11-19)13-22(26)25-18-9-12-21(24-15-18)23-14-17-5-3-4-6-20(17)28-2/h3-12,15H,13-14H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyZHCNZQBZTZQOFE-UHFFFAOYSA-N
XLogP3.89
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide (CID 113012370) is 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide is COc1ccc(CC(=O)Nc2ccc(NCc3ccccc3OC)nc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide?
The InChIKey is ZHCNZQBZTZQOFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-27-19-10-7-16(8-11-19)13-22(26)25-18-9-12-21(24-15-18)23-14-17-5-3-4-6-20(17)28-2/h3-12,15H,13-14H2,1-2H3,(H,23,24)(H,25,26).
What are the key properties of 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide?
2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide has a molecular weight of 377.44 g/mol, XLogP of 3.89, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide is sourced from PubChem (CID 113012370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).