3-(2,3,4-trimethoxyphenyl)benzamide

C16H17NO4 — CID 174562773

IUPAC3-(2,3,4-trimethoxyphenyl)benzamide
SMILESCOc1ccc(-c2cccc(C(N)=O)c2)c(OC)c1OC
InChIInChI=1S/C16H17NO4/c1-19-13-8-7-12(14(20-2)15(13)21-3)10-5-4-6-11(9-10)16(17)18/h4-9H,1-3H3,(H2,17,18)
InChIKeyOXZYSJQVTGJALJ-UHFFFAOYSA-N
MW287.32 g/mol
LogP2.48
Rot. Bonds5

About 3-(2,3,4-trimethoxyphenyl)benzamide

3-(2,3,4-trimethoxyphenyl)benzamide (PubChem CID 174562773) has the molecular formula C16H17NO4 and a molecular weight of 287.32 g/mol. Its IUPAC name is 3-(2,3,4-trimethoxyphenyl)benzamide.

Molecular Properties

Compound Name3-(2,3,4-trimethoxyphenyl)benzamide
PubChem CID174562773
Molecular FormulaC16H17NO4
Molecular Weight287.32 g/mol
Exact Mass287.12
IUPAC Name3-(2,3,4-trimethoxyphenyl)benzamide
SMILESCOc1ccc(-c2cccc(C(N)=O)c2)c(OC)c1OC
InChIInChI=1S/C16H17NO4/c1-19-13-8-7-12(14(20-2)15(13)21-3)10-5-4-6-11(9-10)16(17)18/h4-9H,1-3H3,(H2,17,18)
InChIKeyOXZYSJQVTGJALJ-UHFFFAOYSA-N
XLogP2.48
TPSA70.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(4-methoxynaphthalen-1-yl)phenyl]ethanone
CID 61033105
3-(3-fluoro-4-methoxyphenyl)benzamide
CID 68818750
4-methoxy-3-(3-methoxyphenyl)benzamide
CID 123866555
4-(2,3,4-trimethoxyphenyl)cyclohepta-2,4,6-trien-1-one
CID 15011206
2,6-dimethoxy-3-phenylbenzamide
CID 68897697
2-(2-thiophen-2-ylphenyl)-1-[3-(2,3,4-trimethoxyphenyl)phenyl]ethanone
CID 58318517
3-[4-[1-(dimethylamino)-1-oxopropan-2-yl]oxynaphthalen-1-yl]benzamide
CID 172670829
5-(2,3,4-trimethoxyphenyl)pyridine-3-carboxylic acid
CID 39233473
methyl 2-amino-5-(2,3,4-trimethoxyphenyl)benzoate
CID 82572924
3-[2-amino-3-(3,4,5-trimethoxybenzenecarboximidoyl)-4-pyridinyl]benzamide
CID 123684521
3-(8-methoxyquinolin-5-yl)benzoic acid
CID 82039973
3-[[(3,4,5-trimethoxybenzoyl)amino]carbamoyl]benzamide
CID 43056910

Frequently Asked Questions

What is the IUPAC name of 3-(2,3,4-trimethoxyphenyl)benzamide?
The IUPAC name of 3-(2,3,4-trimethoxyphenyl)benzamide (CID 174562773) is 3-(2,3,4-trimethoxyphenyl)benzamide.
What is the SMILES notation for 3-(2,3,4-trimethoxyphenyl)benzamide?
The canonical SMILES for 3-(2,3,4-trimethoxyphenyl)benzamide is COc1ccc(-c2cccc(C(N)=O)c2)c(OC)c1OC.
What is the InChIKey of 3-(2,3,4-trimethoxyphenyl)benzamide?
The InChIKey is OXZYSJQVTGJALJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO4/c1-19-13-8-7-12(14(20-2)15(13)21-3)10-5-4-6-11(9-10)16(17)18/h4-9H,1-3H3,(H2,17,18).
What are the key properties of 3-(2,3,4-trimethoxyphenyl)benzamide?
3-(2,3,4-trimethoxyphenyl)benzamide has a molecular weight of 287.32 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3,4-trimethoxyphenyl)benzamide is sourced from PubChem (CID 174562773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).