3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide

C19H23NO5 — CID 113095830

IUPAC3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
SMILESCOc1cccc(C(=O)N(C)Cc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C19H23NO5/c1-20(19(21)14-7-6-8-15(11-14)22-2)12-13-9-16(23-3)18(25-5)17(10-13)24-4/h6-11H,12H2,1-5H3
InChIKeyZLHLTYCEGZVPSX-UHFFFAOYSA-N
MW345.40 g/mol
LogP2.99
Rot. Bonds7

About 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide

3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide (PubChem CID 113095830) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
PubChem CID113095830
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC Name3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
SMILESCOc1cccc(C(=O)N(C)Cc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C19H23NO5/c1-20(19(21)14-7-6-8-15(11-14)22-2)12-13-9-16(23-3)18(25-5)17(10-13)24-4/h6-11H,12H2,1-5H3
InChIKeyZLHLTYCEGZVPSX-UHFFFAOYSA-N
XLogP2.99
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 90854315
3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 22070414
N-[(3-fluoro-4-methoxyphenyl)methyl]-3-methoxy-N-methylbenzamide
CID 78796913
N-benzyl-3,4,5-trimethoxy-N-methylbenzamide
CID 669607
N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-phenoxybenzamide
CID 17442743
N-ethyl-3-methoxy-N-methylbenzamide
CID 15816607
N-[(5-bromothiophen-3-yl)methyl]-3-methoxy-N-methylbenzamide
CID 54983997
N-[(3S)-1,1-dioxothiolan-3-yl]-3-methoxy-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 27315976
2-chloro-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 113095840
(3-methoxyphenyl)-(3,4,5-trimethoxyphenyl)methanone
CID 10902719
2-bromo-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 113095826
N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-methylsulfonylbenzamide
CID 18111551

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
The IUPAC name of 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide (CID 113095830) is 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide.
What is the SMILES notation for 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
The canonical SMILES for 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide is COc1cccc(C(=O)N(C)Cc2cc(OC)c(OC)c(OC)c2)c1.
What is the InChIKey of 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
The InChIKey is ZLHLTYCEGZVPSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-20(19(21)14-7-6-8-15(11-14)22-2)12-13-9-16(23-3)18(25-5)17(10-13)24-4/h6-11H,12H2,1-5H3.
What are the key properties of 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide?
3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide has a molecular weight of 345.40 g/mol, XLogP of 2.99, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide is sourced from PubChem (CID 113095830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).