2-ethyl-4-hydroxy-3,5-dimethoxybenzamide

C11H15NO4 — CID 87219413

IUPAC2-ethyl-4-hydroxy-3,5-dimethoxybenzamide
SMILESCCc1c(C(N)=O)cc(OC)c(O)c1OC
InChIInChI=1S/C11H15NO4/c1-4-6-7(11(12)14)5-8(15-2)9(13)10(6)16-3/h5,13H,4H2,1-3H3,(H2,12,14)
InChIKeyFEPLOODZSWSPHV-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.07
Rot. Bonds4

About 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide

2-ethyl-4-hydroxy-3,5-dimethoxybenzamide (PubChem CID 87219413) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide.

Molecular Properties

Compound Name2-ethyl-4-hydroxy-3,5-dimethoxybenzamide
PubChem CID87219413
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name2-ethyl-4-hydroxy-3,5-dimethoxybenzamide
SMILESCCc1c(C(N)=O)cc(OC)c(O)c1OC
InChIInChI=1S/C11H15NO4/c1-4-6-7(11(12)14)5-8(15-2)9(13)10(6)16-3/h5,13H,4H2,1-3H3,(H2,12,14)
InChIKeyFEPLOODZSWSPHV-UHFFFAOYSA-N
XLogP1.07
TPSA81.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide?
The IUPAC name of 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide (CID 87219413) is 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide.
What is the SMILES notation for 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide?
The canonical SMILES for 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide is CCc1c(C(N)=O)cc(OC)c(O)c1OC.
What is the InChIKey of 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide?
The InChIKey is FEPLOODZSWSPHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-4-6-7(11(12)14)5-8(15-2)9(13)10(6)16-3/h5,13H,4H2,1-3H3,(H2,12,14).
What are the key properties of 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide?
2-ethyl-4-hydroxy-3,5-dimethoxybenzamide has a molecular weight of 225.24 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-hydroxy-3,5-dimethoxybenzamide is sourced from PubChem (CID 87219413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).