2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide

C24H26N2O3 — CID 53148124

IUPAC2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide
SMILESCOc1ccc(-c2nc(C)cc(C)c2CNC(=O)Cc2cccc(OC)c2)cc1
InChIInChI=1S/C24H26N2O3/c1-16-12-17(2)26-24(19-8-10-20(28-3)11-9-19)22(16)15-25-23(27)14-18-6-5-7-21(13-18)29-4/h5-13H,14-15H2,1-4H3,(H,25,27)
InChIKeyAJGUXPMHHJHLBK-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.24
Rot. Bonds7

About 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide

2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide (PubChem CID 53148124) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide
PubChem CID53148124
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC Name2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide
SMILESCOc1ccc(-c2nc(C)cc(C)c2CNC(=O)Cc2cccc(OC)c2)cc1
InChIInChI=1S/C24H26N2O3/c1-16-12-17(2)26-24(19-8-10-20(28-3)11-9-19)22(16)15-25-23(27)14-18-6-5-7-21(13-18)29-4/h5-13H,14-15H2,1-4H3,(H,25,27)
InChIKeyAJGUXPMHHJHLBK-UHFFFAOYSA-N
XLogP4.24
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide (CID 53148124) is 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide is COc1ccc(-c2nc(C)cc(C)c2CNC(=O)Cc2cccc(OC)c2)cc1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide?
The InChIKey is AJGUXPMHHJHLBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-16-12-17(2)26-24(19-8-10-20(28-3)11-9-19)22(16)15-25-23(27)14-18-6-5-7-21(13-18)29-4/h5-13H,14-15H2,1-4H3,(H,25,27).
What are the key properties of 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide?
2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide has a molecular weight of 390.48 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide is sourced from PubChem (CID 53148124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).