2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide

C20H26N2O3 — CID 54822434

IUPAC2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide
SMILESCCC(NC(=O)CNc1ccc(OCCOC)cc1)c1ccccc1
InChIInChI=1S/C20H26N2O3/c1-3-19(16-7-5-4-6-8-16)22-20(23)15-21-17-9-11-18(12-10-17)25-14-13-24-2/h4-12,19,21H,3,13-15H2,1-2H3,(H,22,23)
InChIKeyPYPFZMBREXBVIX-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.39
Rot. Bonds10

About 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide

2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide (PubChem CID 54822434) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide
PubChem CID54822434
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC Name2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide
SMILESCCC(NC(=O)CNc1ccc(OCCOC)cc1)c1ccccc1
InChIInChI=1S/C20H26N2O3/c1-3-19(16-7-5-4-6-8-16)22-20(23)15-21-17-9-11-18(12-10-17)25-14-13-24-2/h4-12,19,21H,3,13-15H2,1-2H3,(H,22,23)
InChIKeyPYPFZMBREXBVIX-UHFFFAOYSA-N
XLogP3.39
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[4-(2-phenylethoxy)anilino]-N-(1-phenylpropyl)acetamide
CID 54823876
2-(4-bromoanilino)-N-(1-phenylpropyl)acetamide
CID 54811171
2-(4-butoxyanilino)-N-(1-phenylethyl)acetamide
CID 54820323
2-(naphthalen-2-ylamino)-N-(1-phenylpropyl)acetamide
CID 54839833
2-(4-methoxyphenoxy)-N-(1-phenylpropyl)acetamide
CID 17328005
N-[4-[[2-oxo-2-[4-(2-phenoxyethoxy)anilino]ethyl]amino]phenyl]propanamide
CID 54835679
2-(2-methoxyethoxy)-N-(1-phenylpropyl)acetamide
CID 103612351
2-[4-(2-methoxyethoxy)anilino]-N-[4-(2-phenylethoxy)phenyl]acetamide
CID 54822166
2-(4-ethoxyanilino)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54811661
3-amino-N-[4-(2-methoxyethoxy)phenyl]-3-phenylpropanamide
CID 119949874
N-butan-2-yl-2-[4-(2-phenylethoxy)anilino]acetamide
CID 54823902
2-[4-(2-phenoxyethoxy)anilino]-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 54823077

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide?
The IUPAC name of 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide (CID 54822434) is 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide.
What is the SMILES notation for 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide?
The canonical SMILES for 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide is CCC(NC(=O)CNc1ccc(OCCOC)cc1)c1ccccc1.
What is the InChIKey of 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide?
The InChIKey is PYPFZMBREXBVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-3-19(16-7-5-4-6-8-16)22-20(23)15-21-17-9-11-18(12-10-17)25-14-13-24-2/h4-12,19,21H,3,13-15H2,1-2H3,(H,22,23).
What are the key properties of 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide?
2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide has a molecular weight of 342.44 g/mol, XLogP of 3.39, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide is sourced from PubChem (CID 54822434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).