3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide

C18H21NO3 — CID 898309

IUPAC3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccc(OC)cc2)cc1
InChIInChI=1S/C18H21NO3/c1-21-16-8-3-14(4-9-16)7-12-18(20)19-13-15-5-10-17(22-2)11-6-15/h3-6,8-11H,7,12-13H2,1-2H3,(H,19,20)
InChIKeyYZKJDYQNSSCIAB-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.95
Rot. Bonds7

About 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide

3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide (PubChem CID 898309) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide
PubChem CID898309
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccc(OC)cc2)cc1
InChIInChI=1S/C18H21NO3/c1-21-16-8-3-14(4-9-16)7-12-18(20)19-13-15-5-10-17(22-2)11-6-15/h3-6,8-11H,7,12-13H2,1-2H3,(H,19,20)
InChIKeyYZKJDYQNSSCIAB-UHFFFAOYSA-N
XLogP2.95
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-hydroxyphenyl)methyl]-3-(4-methoxyphenyl)propanamide
CID 115577590
3-(4-methoxyphenyl)-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 52573357
3-(4-methoxyphenyl)-N-[(4-methylsulfonylphenyl)methyl]propanamide
CID 110784513
3-(3,4-difluorophenyl)-N-[(4-methoxyphenyl)methyl]propanamide
CID 39089240
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(4-methoxyphenyl)propanamide
CID 110902384
N-[(4-methoxyphenyl)methyl]-4-oxopentanamide
CID 60636923
2-methoxy-N-[(4-methoxyphenyl)methyl]acetamide
CID 885776
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]-3-(4-methoxyphenyl)propanamide
CID 121137428
N-[(4-methoxyphenyl)methyl]pentanamide
CID 2169969
3-(4-methoxyphenyl)-N-[8-[3-(4-methoxyphenyl)propanoylamino]octyl]propanamide
CID 4661025
3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
CID 18167253
N-[(4-methoxyphenyl)methyl]-3-(2-methyl-1,3-oxazol-4-yl)propanamide
CID 110679194

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide (CID 898309) is 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide is COc1ccc(CCC(=O)NCc2ccc(OC)cc2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide?
The InChIKey is YZKJDYQNSSCIAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-21-16-8-3-14(4-9-16)7-12-18(20)19-13-15-5-10-17(22-2)11-6-15/h3-6,8-11H,7,12-13H2,1-2H3,(H,19,20).
What are the key properties of 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide?
3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide has a molecular weight of 299.37 g/mol, XLogP of 2.95, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide is sourced from PubChem (CID 898309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).