4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide

C20H25NO4 — CID 7935064

IUPAC4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
SMILESCCOc1ccccc1NC(=O)CCCOc1ccccc1OCC
InChIInChI=1S/C20H25NO4/c1-3-23-17-11-6-5-10-16(17)21-20(22)14-9-15-25-19-13-8-7-12-18(19)24-4-2/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,21,22)
InChIKeyDQIVNJNQVOQNTR-UHFFFAOYSA-N
MW343.42 g/mol
LogP4.28
Rot. Bonds10

About 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide

4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide (PubChem CID 7935064) has the molecular formula C20H25NO4 and a molecular weight of 343.42 g/mol. Its IUPAC name is 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide.

Molecular Properties

Compound Name4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
PubChem CID7935064
Molecular FormulaC20H25NO4
Molecular Weight343.42 g/mol
Exact Mass343.18
IUPAC Name4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
SMILESCCOc1ccccc1NC(=O)CCCOc1ccccc1OCC
InChIInChI=1S/C20H25NO4/c1-3-23-17-11-6-5-10-16(17)21-20(22)14-9-15-25-19-13-8-7-12-18(19)24-4-2/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,21,22)
InChIKeyDQIVNJNQVOQNTR-UHFFFAOYSA-N
XLogP4.28
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide?
The IUPAC name of 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide (CID 7935064) is 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide.
What is the SMILES notation for 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide?
The canonical SMILES for 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide is CCOc1ccccc1NC(=O)CCCOc1ccccc1OCC.
What is the InChIKey of 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide?
The InChIKey is DQIVNJNQVOQNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO4/c1-3-23-17-11-6-5-10-16(17)21-20(22)14-9-15-25-19-13-8-7-12-18(19)24-4-2/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,21,22).
What are the key properties of 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide?
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide has a molecular weight of 343.42 g/mol, XLogP of 4.28, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide is sourced from PubChem (CID 7935064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).