N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide

C21H20N2O3 — CID 112987353

IUPACN-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide
SMILESCOc1ccccc1Nc1ccc(NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C21H20N2O3/c1-25-20-10-6-5-9-19(20)22-16-11-13-17(14-12-16)23-21(24)15-26-18-7-3-2-4-8-18/h2-14,22H,15H2,1H3,(H,23,24)
InChIKeyOGMZPRYDFKQUPF-UHFFFAOYSA-N
MW348.40 g/mol
LogP4.46
Rot. Bonds7

About N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide

N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide (PubChem CID 112987353) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide
PubChem CID112987353
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide
SMILESCOc1ccccc1Nc1ccc(NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C21H20N2O3/c1-25-20-10-6-5-9-19(20)22-16-11-13-17(14-12-16)23-21(24)15-26-18-7-3-2-4-8-18/h2-14,22H,15H2,1H3,(H,23,24)
InChIKeyOGMZPRYDFKQUPF-UHFFFAOYSA-N
XLogP4.46
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[2-(2-methoxyanilino)-2-oxoethoxy]phenyl]benzamide
CID 9252851
N-[4-(2,3-dimethylanilino)phenyl]-2-phenoxyacetamide
CID 112986448
N-(2-anilinophenyl)-2-phenoxyacetamide
CID 23903366
N-(4-acetamidophenyl)-2-phenoxyacetamide
CID 675023
2-(4-methoxyphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 833180
N-[4-(2,5-dimethoxyanilino)phenyl]-2-(4-methylphenoxy)acetamide
CID 112987885
N-[4-(2-methoxyanilino)phenyl]pentanamide
CID 112987324
4-[[2-(4-chlorophenoxy)acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 7816201
2-(4-hydroxyphenoxy)-N-(2-methoxyphenyl)acetamide
CID 43326297
N-[5-(2-ethoxyanilino)-2-pyridinyl]-2-phenoxyacetamide
CID 113034277
N-[4-[4-(dimethylamino)anilino]phenyl]-2-phenoxyacetamide
CID 112988677
N-[4-[2-(2-methoxyphenyl)-2-oxoethyl]sulfanylphenyl]-2-phenoxyacetamide
CID 19631701

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide?
The IUPAC name of N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide (CID 112987353) is N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide is COc1ccccc1Nc1ccc(NC(=O)COc2ccccc2)cc1.
What is the InChIKey of N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide?
The InChIKey is OGMZPRYDFKQUPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-25-20-10-6-5-9-19(20)22-16-11-13-17(14-12-16)23-21(24)15-26-18-7-3-2-4-8-18/h2-14,22H,15H2,1H3,(H,23,24).
What are the key properties of N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide?
N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide has a molecular weight of 348.40 g/mol, XLogP of 4.46, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxyanilino)phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 112987353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).