N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide

C19H23NO4 — CID 132651370

IUPACN-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide
SMILESCCC(NC(=O)c1ccc(OC)cc1)c1ccc(OC)c(OC)c1
InChIInChI=1S/C19H23NO4/c1-5-16(14-8-11-17(23-3)18(12-14)24-4)20-19(21)13-6-9-15(22-2)10-7-13/h6-12,16H,5H2,1-4H3,(H,20,21)
InChIKeyFTBRUCGFKIVGTK-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.59
Rot. Bonds7

About N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide

N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide (PubChem CID 132651370) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide
PubChem CID132651370
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC NameN-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide
SMILESCCC(NC(=O)c1ccc(OC)cc1)c1ccc(OC)c(OC)c1
InChIInChI=1S/C19H23NO4/c1-5-16(14-8-11-17(23-3)18(12-14)24-4)20-19(21)13-6-9-15(22-2)10-7-13/h6-12,16H,5H2,1-4H3,(H,20,21)
InChIKeyFTBRUCGFKIVGTK-UHFFFAOYSA-N
XLogP3.59
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[1-(4-methoxy-3-methylphenyl)propyl]benzamide
CID 133210902
4-methoxy-N-[1-(4-methoxyphenyl)propyl]benzamide
CID 43904504
N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide
CID 7311220
N-[1-(3,4-dimethoxyphenyl)propyl]-3,4-dimethylbenzamide
CID 133201858
3-fluoro-4-methoxy-N-[(1R)-1-(4-methoxyphenyl)propyl]benzamide
CID 27853735
3-fluoro-4-methoxy-N-[1-(4-methoxyphenyl)propyl]benzamide
CID 51199371
3-chloro-N-[(1S)-1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide
CID 100648795
N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]-2,6-dimethylpyridine-4-carboxamide
CID 99933793
3-methoxy-N-[1-(4-methoxyphenyl)propyl]-4-prop-2-enoxybenzamide
CID 24547727
N-[(1S)-1-(3,4-dimethoxyphenyl)propyl]-2,4,5-trimethylbenzamide
CID 100711328
N-[1-(4-methoxy-3-methylphenyl)propyl]-4-propoxybenzamide
CID 133160886
N-[1-(3,4-dimethoxyphenyl)propyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 133231412

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide?
The IUPAC name of N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide (CID 132651370) is N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide.
What is the SMILES notation for N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide?
The canonical SMILES for N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide is CCC(NC(=O)c1ccc(OC)cc1)c1ccc(OC)c(OC)c1.
What is the InChIKey of N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide?
The InChIKey is FTBRUCGFKIVGTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-5-16(14-8-11-17(23-3)18(12-14)24-4)20-19(21)13-6-9-15(22-2)10-7-13/h6-12,16H,5H2,1-4H3,(H,20,21).
What are the key properties of N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide?
N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide has a molecular weight of 329.40 g/mol, XLogP of 3.59, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide is sourced from PubChem (CID 132651370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).