2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide

C22H22N2O2 — CID 66538833

IUPAC2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2CNc2ccccc2)cc1
InChIInChI=1S/C22H22N2O2/c1-17-11-13-20(14-12-17)24-22(25)16-26-21-10-6-5-7-18(21)15-23-19-8-3-2-4-9-19/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyDUARJFCOFBGSOR-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.62
Rot. Bonds7

About 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide

2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide (PubChem CID 66538833) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide
PubChem CID66538833
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC Name2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2CNc2ccccc2)cc1
InChIInChI=1S/C22H22N2O2/c1-17-11-13-20(14-12-17)24-22(25)16-26-21-10-6-5-7-18(21)15-23-19-8-3-2-4-9-19/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyDUARJFCOFBGSOR-UHFFFAOYSA-N
XLogP4.62
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[(3,4-dichloroanilino)methyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 66538843
2-(2-methoxyphenoxy)-N-[4-[(2-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982660
2-[2-[(cyclohexylamino)methyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 2164253
2-[4-(anilinomethyl)-2-chlorophenoxy]-N-(4-methylphenyl)acetamide
CID 4593347
2-[2-(anilinomethyl)phenoxy]acetic acid
CID 126116290
2-[2-[(3,4-dichloroanilino)methyl]phenoxy]-N-(3-methylphenyl)acetamide
CID 126212904
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
2-[4-chloro-2-[(3,5-dichloroanilino)methyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 66539842
2-(4-methylphenoxy)-N-[4-[(4-methylphenyl)methylamino]phenyl]acetamide
CID 112982175
4-[[2-(2-ethylphenoxy)acetyl]amino]benzamide
CID 724713
2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide
CID 54793411
4-methyl-N-[(2-propoxyphenyl)methyl]aniline
CID 39357777

Frequently Asked Questions

What is the IUPAC name of 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide (CID 66538833) is 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)COc2ccccc2CNc2ccccc2)cc1.
What is the InChIKey of 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide?
The InChIKey is DUARJFCOFBGSOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-17-11-13-20(14-12-17)24-22(25)16-26-21-10-6-5-7-18(21)15-23-19-8-3-2-4-9-19/h2-14,23H,15-16H2,1H3,(H,24,25).
What are the key properties of 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide?
2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide has a molecular weight of 346.43 g/mol, XLogP of 4.62, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 66538833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).