2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide

C24H25NO4 — CID 27865855

IUPAC2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)cc1
InChIInChI=1S/C24H25NO4/c1-27-21-11-8-18(9-12-21)15-24(26)25-16-20-10-13-22(23(14-20)28-2)29-17-19-6-4-3-5-7-19/h3-14H,15-17H2,1-2H3,(H,25,26)
InChIKeySGGIECKMDHKFKT-UHFFFAOYSA-N
MW391.47 g/mol
LogP4.14
Rot. Bonds9

About 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide

2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide (PubChem CID 27865855) has the molecular formula C24H25NO4 and a molecular weight of 391.47 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide
PubChem CID27865855
Molecular FormulaC24H25NO4
Molecular Weight391.47 g/mol
Exact Mass391.18
IUPAC Name2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)cc1
InChIInChI=1S/C24H25NO4/c1-27-21-11-8-18(9-12-21)15-24(26)25-16-20-10-13-22(23(14-20)28-2)29-17-19-6-4-3-5-7-19/h3-14H,15-17H2,1-2H3,(H,25,26)
InChIKeySGGIECKMDHKFKT-UHFFFAOYSA-N
XLogP4.14
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide (CID 27865855) is 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide is COc1ccc(CC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide?
The InChIKey is SGGIECKMDHKFKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO4/c1-27-21-11-8-18(9-12-21)15-24(26)25-16-20-10-13-22(23(14-20)28-2)29-17-19-6-4-3-5-7-19/h3-14H,15-17H2,1-2H3,(H,25,26).
What are the key properties of 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide?
2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide has a molecular weight of 391.47 g/mol, XLogP of 4.14, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 27865855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).