2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide

C26H30N2O4 — CID 54827361

IUPAC2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide
SMILESCCOCCOc1cccc(NCC(=O)Nc2cccc(OCCc3ccccc3)c2)c1
InChIInChI=1S/C26H30N2O4/c1-2-30-16-17-32-24-12-6-10-22(18-24)27-20-26(29)28-23-11-7-13-25(19-23)31-15-14-21-8-4-3-5-9-21/h3-13,18-19,27H,2,14-17,20H2,1H3,(H,28,29)
InChIKeyNFKCNCLXMJRYTD-UHFFFAOYSA-N
MW434.54 g/mol
LogP4.77
Rot. Bonds13

About 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide

2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide (PubChem CID 54827361) has the molecular formula C26H30N2O4 and a molecular weight of 434.54 g/mol. Its IUPAC name is 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide
PubChem CID54827361
Molecular FormulaC26H30N2O4
Molecular Weight434.54 g/mol
Exact Mass434.22
IUPAC Name2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide
SMILESCCOCCOc1cccc(NCC(=O)Nc2cccc(OCCc3ccccc3)c2)c1
InChIInChI=1S/C26H30N2O4/c1-2-30-16-17-32-24-12-6-10-22(18-24)27-20-26(29)28-23-11-7-13-25(19-23)31-15-14-21-8-4-3-5-9-21/h3-13,18-19,27H,2,14-17,20H2,1H3,(H,28,29)
InChIKeyNFKCNCLXMJRYTD-UHFFFAOYSA-N
XLogP4.77
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54827581
N-[4-(2-ethoxyethoxy)phenyl]-2-[3-(2-phenoxyethoxy)anilino]acetamide
CID 54825982
N-[3-[[2-[3-(2-ethoxyethoxy)anilino]acetyl]amino]phenyl]propanamide
CID 54827552
N-benzyl-3-[[2-[3-(2-ethoxyethoxy)anilino]acetyl]amino]-N-methylbenzamide
CID 54827428
N-benzyl-3-[[2-[3-(2-ethoxyethoxy)anilino]acetyl]amino]benzamide
CID 54827557
N-(3,4-dimethylphenyl)-2-[3-(2-ethoxyethoxy)anilino]acetamide
CID 54827735
N-(3-chlorophenyl)-2-[3-(2-phenylethoxy)anilino]acetamide
CID 54828339
2-(4-ethoxyanilino)-N-[3-(2-ethoxyethoxy)phenyl]acetamide
CID 54811569
N-[3-[[2-oxo-2-[3-(2-phenoxyethoxy)anilino]ethyl]amino]phenyl]-3-phenylpropanamide
CID 54837399
N-(2,6-dimethylphenyl)-2-[3-(2-phenylethoxy)anilino]acetamide
CID 54828309
N-methyl-3-[[2-oxo-2-[3-(2-phenylethoxy)anilino]ethyl]amino]benzamide
CID 54839558
N-[3-[[2-[3-(2-methoxyethoxy)anilino]acetyl]amino]phenyl]-3-phenylpropanamide
CID 54829756

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide?
The IUPAC name of 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide (CID 54827361) is 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide.
What is the SMILES notation for 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide?
The canonical SMILES for 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide is CCOCCOc1cccc(NCC(=O)Nc2cccc(OCCc3ccccc3)c2)c1.
What is the InChIKey of 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide?
The InChIKey is NFKCNCLXMJRYTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N2O4/c1-2-30-16-17-32-24-12-6-10-22(18-24)27-20-26(29)28-23-11-7-13-25(19-23)31-15-14-21-8-4-3-5-9-21/h3-13,18-19,27H,2,14-17,20H2,1H3,(H,28,29).
What are the key properties of 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide?
2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide has a molecular weight of 434.54 g/mol, XLogP of 4.77, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenylethoxy)phenyl]acetamide is sourced from PubChem (CID 54827361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).