N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide

C20H18N2O4 — CID 90596489

IUPACN-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(Oc3ccccn3)c2)c1
InChIInChI=1S/C20H18N2O4/c1-24-15-9-10-18(25-2)17(13-15)22-20(23)14-6-5-7-16(12-14)26-19-8-3-4-11-21-19/h3-13H,1-2H3,(H,22,23)
InChIKeyBAARHHRUWCAOQW-UHFFFAOYSA-N
MW350.37 g/mol
LogP4.14
Rot. Bonds6

About N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide

N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide (PubChem CID 90596489) has the molecular formula C20H18N2O4 and a molecular weight of 350.37 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide
PubChem CID90596489
Molecular FormulaC20H18N2O4
Molecular Weight350.37 g/mol
Exact Mass350.13
IUPAC NameN-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide
SMILESCOc1ccc(OC)c(NC(=O)c2cccc(Oc3ccccn3)c2)c1
InChIInChI=1S/C20H18N2O4/c1-24-15-9-10-18(25-2)17(13-15)22-20(23)14-6-5-7-16(12-14)26-19-8-3-4-11-21-19/h3-13H,1-2H3,(H,22,23)
InChIKeyBAARHHRUWCAOQW-UHFFFAOYSA-N
XLogP4.14
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.37
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide (CID 90596489) is N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide is COc1ccc(OC)c(NC(=O)c2cccc(Oc3ccccn3)c2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide?
The InChIKey is BAARHHRUWCAOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O4/c1-24-15-9-10-18(25-2)17(13-15)22-20(23)14-6-5-7-16(12-14)26-19-8-3-4-11-21-19/h3-13H,1-2H3,(H,22,23).
What are the key properties of N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide?
N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide has a molecular weight of 350.37 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-3-pyridin-2-yloxybenzamide is sourced from PubChem (CID 90596489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).