2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide

C17H20N2O2 — CID 43738439

IUPAC2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide
SMILESCCOc1ccc(CNc2ccccc2CC(N)=O)cc1
InChIInChI=1S/C17H20N2O2/c1-2-21-15-9-7-13(8-10-15)12-19-16-6-4-3-5-14(16)11-17(18)20/h3-10,19H,2,11-12H2,1H3,(H2,18,20)
InChIKeyUYBDRSZRSTVGOU-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.73
Rot. Bonds7

About 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide

2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide (PubChem CID 43738439) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide
PubChem CID43738439
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide
SMILESCCOc1ccc(CNc2ccccc2CC(N)=O)cc1
InChIInChI=1S/C17H20N2O2/c1-2-21-15-9-7-13(8-10-15)12-19-16-6-4-3-5-14(16)11-17(18)20/h3-10,19H,2,11-12H2,1H3,(H2,18,20)
InChIKeyUYBDRSZRSTVGOU-UHFFFAOYSA-N
XLogP2.73
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide?
The IUPAC name of 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide (CID 43738439) is 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide.
What is the SMILES notation for 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide?
The canonical SMILES for 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide is CCOc1ccc(CNc2ccccc2CC(N)=O)cc1.
What is the InChIKey of 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide?
The InChIKey is UYBDRSZRSTVGOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-2-21-15-9-7-13(8-10-15)12-19-16-6-4-3-5-14(16)11-17(18)20/h3-10,19H,2,11-12H2,1H3,(H2,18,20).
What are the key properties of 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide?
2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide has a molecular weight of 284.36 g/mol, XLogP of 2.73, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(4-ethoxyphenyl)methylamino]phenyl]acetamide is sourced from PubChem (CID 43738439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).