N-(2-acetylphenyl)-3,4-dimethoxybenzamide

C17H17NO4 — CID 17394178

IUPACN-(2-acetylphenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(C)=O)cc1OC
InChIInChI=1S/C17H17NO4/c1-11(19)13-6-4-5-7-14(13)18-17(20)12-8-9-15(21-2)16(10-12)22-3/h4-10H,1-3H3,(H,18,20)
InChIKeyAYJJKIPKRCADJJ-UHFFFAOYSA-N
MW299.33 g/mol
LogP3.16
Rot. Bonds5

About N-(2-acetylphenyl)-3,4-dimethoxybenzamide

N-(2-acetylphenyl)-3,4-dimethoxybenzamide (PubChem CID 17394178) has the molecular formula C17H17NO4 and a molecular weight of 299.33 g/mol. Its IUPAC name is N-(2-acetylphenyl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-3,4-dimethoxybenzamide
PubChem CID17394178
Molecular FormulaC17H17NO4
Molecular Weight299.33 g/mol
Exact Mass299.12
IUPAC NameN-(2-acetylphenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2C(C)=O)cc1OC
InChIInChI=1S/C17H17NO4/c1-11(19)13-6-4-5-7-14(13)18-17(20)12-8-9-15(21-2)16(10-12)22-3/h4-10H,1-3H3,(H,18,20)
InChIKeyAYJJKIPKRCADJJ-UHFFFAOYSA-N
XLogP3.16
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-acetylphenyl)-4-methoxy-3-nitrobenzamide
CID 7948545
N-[2-[(3-chloro-4-methoxyphenyl)carbamoyl]phenyl]-3,4-dimethoxybenzamide
CID 2185661
3,4-dimethoxy-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide
CID 18089928
N-(2-acetylphenyl)-4-methoxybenzamide
CID 3509429
N-[2-[N-(2-aminophenyl)-C-methylcarbonimidoyl]phenyl]-3,4-dimethoxybenzamide
CID 58816470
2-bromo-N-[2-[[(3,4-dimethoxybenzoyl)amino]carbamoyl]phenyl]benzamide
CID 55358458
N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide
CID 110602599
3,4-dimethoxy-N-[2-[1-[(1-methyl-2-pyridinylidene)amino]ethenyl]phenyl]benzamide
CID 143409694
methyl 2-[(3-bromo-4-methoxybenzoyl)amino]benzoate
CID 1226570
4-(difluoromethoxy)-3-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 51218194
1-[2-(3,4-dimethoxybenzoyl)phenyl]ethanone
CID 102341182
benzylidene-[[2-[(3,4-dimethoxybenzoyl)amino]benzoyl]amino]-methylazanium
CID 66639148

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(2-acetylphenyl)-3,4-dimethoxybenzamide (CID 17394178) is N-(2-acetylphenyl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(2-acetylphenyl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(2-acetylphenyl)-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2ccccc2C(C)=O)cc1OC.
What is the InChIKey of N-(2-acetylphenyl)-3,4-dimethoxybenzamide?
The InChIKey is AYJJKIPKRCADJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO4/c1-11(19)13-6-4-5-7-14(13)18-17(20)12-8-9-15(21-2)16(10-12)22-3/h4-10H,1-3H3,(H,18,20).
What are the key properties of N-(2-acetylphenyl)-3,4-dimethoxybenzamide?
N-(2-acetylphenyl)-3,4-dimethoxybenzamide has a molecular weight of 299.33 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 17394178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).