2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide

C25H28N2O4 — CID 54827093

IUPAC2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccccc1NC(=O)CNc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C25H28N2O4/c1-19(2)31-24-15-9-7-13-22(24)27-25(28)18-26-21-12-6-8-14-23(21)30-17-16-29-20-10-4-3-5-11-20/h3-15,19,26H,16-18H2,1-2H3,(H,27,28)
InChIKeyXWMDADODZQXAMC-UHFFFAOYSA-N
MW420.51 g/mol
LogP4.98
Rot. Bonds11

About 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide

2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide (PubChem CID 54827093) has the molecular formula C25H28N2O4 and a molecular weight of 420.51 g/mol. Its IUPAC name is 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide
PubChem CID54827093
Molecular FormulaC25H28N2O4
Molecular Weight420.51 g/mol
Exact Mass420.20
IUPAC Name2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccccc1NC(=O)CNc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C25H28N2O4/c1-19(2)31-24-15-9-7-13-22(24)27-25(28)18-26-21-12-6-8-14-23(21)30-17-16-29-20-10-4-3-5-11-20/h3-15,19,26H,16-18H2,1-2H3,(H,27,28)
InChIKeyXWMDADODZQXAMC-UHFFFAOYSA-N
XLogP4.98
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 54.98
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

N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54827090
2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 54817274
N-(2-phenylmethoxyphenyl)-2-(2-propan-2-yloxyanilino)acetamide
CID 54828582
N-[2-(2-phenoxyethoxy)phenyl]-2-(propan-2-ylamino)acetamide
CID 54817766
2-(2-chloroanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 54810463
2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 46995681
2-[[2-oxo-2-[2-(2-phenoxyethoxy)anilino]ethyl]amino]benzamide
CID 54811936
2-[4-(3-methylbutoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 54822042
2-(methylamino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide;hydrochloride
CID 154890001
N-[4-(3-methylbutoxy)phenyl]-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54826935
2-(naphthalen-1-ylamino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54809130
N-[2-(2-phenoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820282

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide (CID 54827093) is 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide is CC(C)Oc1ccccc1NC(=O)CNc1ccccc1OCCOc1ccccc1.
What is the InChIKey of 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide?
The InChIKey is XWMDADODZQXAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O4/c1-19(2)31-24-15-9-7-13-22(24)27-25(28)18-26-21-12-6-8-14-23(21)30-17-16-29-20-10-4-3-5-11-20/h3-15,19,26H,16-18H2,1-2H3,(H,27,28).
What are the key properties of 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide?
2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide has a molecular weight of 420.51 g/mol, XLogP of 4.98, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 54827093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).