N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide

C21H27NO4 — CID 165361972

IUPACN-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CN(CCc2cc(OC)c(C)cc2OC)C(C)=O)cc1
InChIInChI=1S/C21H27NO4/c1-15-12-21(26-5)18(13-20(15)25-4)10-11-22(16(2)23)14-17-6-8-19(24-3)9-7-17/h6-9,12-13H,10-11,14H2,1-5H3
InChIKeyZTARAYBGIOYJIK-UHFFFAOYSA-N
MW357.45 g/mol
LogP3.61
Rot. Bonds8

About N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide

N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide (PubChem CID 165361972) has the molecular formula C21H27NO4 and a molecular weight of 357.45 g/mol. Its IUPAC name is N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide
PubChem CID165361972
Molecular FormulaC21H27NO4
Molecular Weight357.45 g/mol
Exact Mass357.19
IUPAC NameN-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CN(CCc2cc(OC)c(C)cc2OC)C(C)=O)cc1
InChIInChI=1S/C21H27NO4/c1-15-12-21(26-5)18(13-20(15)25-4)10-11-22(16(2)23)14-17-6-8-19(24-3)9-7-17/h6-9,12-13H,10-11,14H2,1-5H3
InChIKeyZTARAYBGIOYJIK-UHFFFAOYSA-N
XLogP3.61
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-(3,4-dimethylphenyl)propanamide
CID 113119942
N-[2-[acetyl-[(4-methoxyphenyl)methyl]amino]ethyl]-2-(2-methylphenyl)acetamide
CID 113055046
N-[2-[acetyl-[(4-methoxyphenyl)methyl]amino]ethyl]-3,5-dimethoxybenzamide
CID 113055017
1-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-1,3-dimethylurea
CID 115169490
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N,N-dipropylacetamide
CID 113163098
N-[2-[acetyl-[(3,4-dimethoxyphenyl)methyl]amino]ethyl]-4-methoxybenzamide
CID 113056323
N-[(2-chloro-6-methylquinolin-3-yl)methyl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 1459808
N-[2-(2,4-dimethoxyphenyl)ethyl]-N-methylacetamide
CID 115191281
N,N-bis[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 68534392
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-(3,4-dimethoxyphenyl)acetamide
CID 113163149
N-[2-[acetyl-[(4-methoxyphenyl)methyl]amino]ethyl]butanamide
CID 113054996
N-[(4-methoxyphenyl)methyl]-N-(tributylstannylmethyl)acetamide
CID 10528779

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide?
The IUPAC name of N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide (CID 165361972) is N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide?
The canonical SMILES for N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide is COc1ccc(CN(CCc2cc(OC)c(C)cc2OC)C(C)=O)cc1.
What is the InChIKey of N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide?
The InChIKey is ZTARAYBGIOYJIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO4/c1-15-12-21(26-5)18(13-20(15)25-4)10-11-22(16(2)23)14-17-6-8-19(24-3)9-7-17/h6-9,12-13H,10-11,14H2,1-5H3.
What are the key properties of N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide?
N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide has a molecular weight of 357.45 g/mol, XLogP of 3.61, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 165361972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).