2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide

C23H23NO3 — CID 51187291

IUPAC2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide
SMILESCOc1ccc(C(NC(=O)Cc2cccc(OC)c2)c2ccccc2)cc1
InChIInChI=1S/C23H23NO3/c1-26-20-13-11-19(12-14-20)23(18-8-4-3-5-9-18)24-22(25)16-17-7-6-10-21(15-17)27-2/h3-15,23H,16H2,1-2H3,(H,24,25)
InChIKeyXIHJNVQCTMIMRB-UHFFFAOYSA-N
MW361.44 g/mol
LogP4.15
Rot. Bonds7

About 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide

2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide (PubChem CID 51187291) has the molecular formula C23H23NO3 and a molecular weight of 361.44 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide
PubChem CID51187291
Molecular FormulaC23H23NO3
Molecular Weight361.44 g/mol
Exact Mass361.17
IUPAC Name2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide
SMILESCOc1ccc(C(NC(=O)Cc2cccc(OC)c2)c2ccccc2)cc1
InChIInChI=1S/C23H23NO3/c1-26-20-13-11-19(12-14-20)23(18-8-4-3-5-9-18)24-22(25)16-17-7-6-10-21(15-17)27-2/h3-15,23H,16H2,1-2H3,(H,24,25)
InChIKeyXIHJNVQCTMIMRB-UHFFFAOYSA-N
XLogP4.15
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide (CID 51187291) is 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide is COc1ccc(C(NC(=O)Cc2cccc(OC)c2)c2ccccc2)cc1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide?
The InChIKey is XIHJNVQCTMIMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO3/c1-26-20-13-11-19(12-14-20)23(18-8-4-3-5-9-18)24-22(25)16-17-7-6-10-21(15-17)27-2/h3-15,23H,16H2,1-2H3,(H,24,25).
What are the key properties of 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide?
2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide has a molecular weight of 361.44 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide is sourced from PubChem (CID 51187291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).