N-(2,5-dimethoxyphenyl)-4-methoxybenzamide

C16H17NO4 — CID 532276

IUPACN-(2,5-dimethoxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C16H17NO4/c1-19-12-6-4-11(5-7-12)16(18)17-14-10-13(20-2)8-9-15(14)21-3/h4-10H,1-3H3,(H,17,18)
InChIKeyCFFUCEHTAUTSAT-UHFFFAOYSA-N
MW287.32 g/mol
LogP2.96
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-4-methoxybenzamide

N-(2,5-dimethoxyphenyl)-4-methoxybenzamide (PubChem CID 532276) has the molecular formula C16H17NO4 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-4-methoxybenzamide
PubChem CID532276
Molecular FormulaC16H17NO4
Molecular Weight287.32 g/mol
Exact Mass287.12
IUPAC NameN-(2,5-dimethoxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C16H17NO4/c1-19-12-6-4-11(5-7-12)16(18)17-14-10-13(20-2)8-9-15(14)21-3/h4-10H,1-3H3,(H,17,18)
InChIKeyCFFUCEHTAUTSAT-UHFFFAOYSA-N
XLogP2.96
TPSA56.79 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 ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-4-methoxybenzamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-4-methoxybenzamide (CID 532276) is N-(2,5-dimethoxyphenyl)-4-methoxybenzamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-4-methoxybenzamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2cc(OC)ccc2OC)cc1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-4-methoxybenzamide?
The InChIKey is CFFUCEHTAUTSAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO4/c1-19-12-6-4-11(5-7-12)16(18)17-14-10-13(20-2)8-9-15(14)21-3/h4-10H,1-3H3,(H,17,18).
What are the key properties of N-(2,5-dimethoxyphenyl)-4-methoxybenzamide?
N-(2,5-dimethoxyphenyl)-4-methoxybenzamide has a molecular weight of 287.32 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-4-methoxybenzamide is sourced from PubChem (CID 532276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).