N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide

C19H23NO5 — CID 7772407

IUPACN-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1ccc(CNC(=O)Cc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C19H23NO5/c1-22-15-7-5-13(6-8-15)12-20-18(21)11-14-9-16(23-2)19(25-4)17(10-14)24-3/h5-10H,11-12H2,1-4H3,(H,20,21)
InChIKeyKMIURKHTKZILRZ-UHFFFAOYSA-N
MW345.40 g/mol
LogP2.58
Rot. Bonds8

About N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide

N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 7772407) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID7772407
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC NameN-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1ccc(CNC(=O)Cc2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C19H23NO5/c1-22-15-7-5-13(6-8-15)12-20-18(21)11-14-9-16(23-2)19(25-4)17(10-14)24-3/h5-10H,11-12H2,1-4H3,(H,20,21)
InChIKeyKMIURKHTKZILRZ-UHFFFAOYSA-N
XLogP2.58
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,4-dimethoxyphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide
CID 9483239
N-(4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2665020
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
N-[(2-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2713308
N-[[4-(azepan-1-ylmethyl)phenyl]methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 60602273
2-(2,4-dimethoxyphenyl)-N-[(4-methylphenyl)methyl]acetamide
CID 9428047
2-(2,4-dimethoxyphenyl)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 9427593
2-(4-methoxyphenyl)-N-[(4-methylphenyl)methyl]acetamide;hydrochloride
CID 142729709
N-[(2,3-dimethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 46590636
2-(2,5-dihydroxyphenyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 71715351
2-(2,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]acetamide
CID 27256771
2-(3,4-dimethoxyphenyl)-N-[[4-(2-methoxyethoxy)phenyl]methyl]acetamide
CID 55662830

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide (CID 7772407) is N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide is COc1ccc(CNC(=O)Cc2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is KMIURKHTKZILRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-22-15-7-5-13(6-8-15)12-20-18(21)11-14-9-16(23-2)19(25-4)17(10-14)24-3/h5-10H,11-12H2,1-4H3,(H,20,21).
What are the key properties of N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide?
N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 345.40 g/mol, XLogP of 2.58, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 7772407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).