N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide

C24H26N2O3 — CID 54827087

IUPACN-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
SMILESCc1cc(C)cc(NC(=O)CNc2ccccc2OCCOc2ccccc2)c1
InChIInChI=1S/C24H26N2O3/c1-18-14-19(2)16-20(15-18)26-24(27)17-25-22-10-6-7-11-23(22)29-13-12-28-21-8-4-3-5-9-21/h3-11,14-16,25H,12-13,17H2,1-2H3,(H,26,27)
InChIKeyAVQRRYXNFLXVHD-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.81
Rot. Bonds9

About N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide

N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide (PubChem CID 54827087) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
PubChem CID54827087
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
SMILESCc1cc(C)cc(NC(=O)CNc2ccccc2OCCOc2ccccc2)c1
InChIInChI=1S/C24H26N2O3/c1-18-14-19(2)16-20(15-18)26-24(27)17-25-22-10-6-7-11-23(22)29-13-12-28-21-8-4-3-5-9-21/h3-11,14-16,25H,12-13,17H2,1-2H3,(H,26,27)
InChIKeyAVQRRYXNFLXVHD-UHFFFAOYSA-N
XLogP4.81
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3,5-dimethylphenyl)-2-[2-(3-phenylpropoxy)anilino]acetamide
CID 54827069
2-(3,5-dimethylanilino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54813315
N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54827090
2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 54817274
N-[3-(3-methylbutoxy)phenyl]-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54827183
2-[2-(2-phenoxyethoxy)anilino]-N-(2,4,5-trichlorophenyl)acetamide
CID 54826934
2-(2-chloroanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 54810463
N-[4-(3-methylbutoxy)phenyl]-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54826935
N-(2,5-dichlorophenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54826760
2-[2-(2-methylprop-2-enoxy)anilino]-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54826186
2-(2-chloroanilino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54810439
2-[2-(2-phenoxyethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 54827093

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide (CID 54827087) is N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide is Cc1cc(C)cc(NC(=O)CNc2ccccc2OCCOc2ccccc2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
The InChIKey is AVQRRYXNFLXVHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-18-14-19(2)16-20(15-18)26-24(27)17-25-22-10-6-7-11-23(22)29-13-12-28-21-8-4-3-5-9-21/h3-11,14-16,25H,12-13,17H2,1-2H3,(H,26,27).
What are the key properties of N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide has a molecular weight of 390.48 g/mol, XLogP of 4.81, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide is sourced from PubChem (CID 54827087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).