3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide

C17H19NO3 — CID 22070414

IUPAC3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
SMILESCOc1cccc(CN(C)C(=O)c2cccc(OC)c2)c1
InChIInChI=1S/C17H19NO3/c1-18(12-13-6-4-8-15(10-13)20-2)17(19)14-7-5-9-16(11-14)21-3/h4-11H,12H2,1-3H3
InChIKeyKOZRABQOGGJEBJ-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.98
Rot. Bonds5

About 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide

3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide (PubChem CID 22070414) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
PubChem CID22070414
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
SMILESCOc1cccc(CN(C)C(=O)c2cccc(OC)c2)c1
InChIInChI=1S/C17H19NO3/c1-18(12-13-6-4-8-15(10-13)20-2)17(19)14-7-5-9-16(11-14)21-3/h4-11H,12H2,1-3H3
InChIKeyKOZRABQOGGJEBJ-UHFFFAOYSA-N
XLogP2.98
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N-methyl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 113095830
3-chloro-4-iodo-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 103221595
N-[(3-fluoro-4-methoxyphenyl)methyl]-3-methoxy-N-methylbenzamide
CID 78796913
3-amino-4-fluoro-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 61115963
N-ethyl-3-methoxy-N-methylbenzamide
CID 15816607
N-[(5-bromothiophen-3-yl)methyl]-3-methoxy-N-methylbenzamide
CID 54983997
ethyl N-[(3-methoxyphenyl)methyl]-N-methylcarbamate
CID 60636271
4-(2-amino-2-oxoethoxy)-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 166194594
2-hydrazinyl-N-[(3-methoxyphenyl)methyl]-N-methylpyridine-4-carboxamide
CID 62243535
2,5-dihydroxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 107722488
3-amino-N-[(3-methoxyphenyl)methyl]-N-methylthiophene-2-carboxamide
CID 54980615
N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-phenoxybenzamide
CID 17442743

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide?
The IUPAC name of 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide (CID 22070414) is 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide.
What is the SMILES notation for 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide?
The canonical SMILES for 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide is COc1cccc(CN(C)C(=O)c2cccc(OC)c2)c1.
What is the InChIKey of 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide?
The InChIKey is KOZRABQOGGJEBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-18(12-13-6-4-8-15(10-13)20-2)17(19)14-7-5-9-16(11-14)21-3/h4-11H,12H2,1-3H3.
What are the key properties of 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide?
3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide has a molecular weight of 285.34 g/mol, XLogP of 2.98, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide is sourced from PubChem (CID 22070414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).