N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide

C22H22N2O2 — CID 108996702

IUPACN-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide
SMILESCc1ccccc1CNC(=O)CNc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C22H22N2O2/c1-17-7-5-6-8-18(17)15-24-22(25)16-23-19-11-13-21(14-12-19)26-20-9-3-2-4-10-20/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyPPFCXRFIFJTHGO-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.52
Rot. Bonds7

About N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide

N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide (PubChem CID 108996702) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide.

Molecular Properties

Compound NameN-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide
PubChem CID108996702
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC NameN-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide
SMILESCc1ccccc1CNC(=O)CNc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C22H22N2O2/c1-17-7-5-6-8-18(17)15-24-22(25)16-23-19-11-13-21(14-12-19)26-20-9-3-2-4-10-20/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyPPFCXRFIFJTHGO-UHFFFAOYSA-N
XLogP4.52
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 ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)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

N-[(2-methylphenyl)methyl]-2-[(2-methylphenyl)methylamino]acetamide
CID 108996489
2-anilino-N-[(2-hydroxyphenyl)methyl]acetamide
CID 114332305
2-anilino-N-[(2-methoxyphenyl)methyl]acetamide
CID 60646954
N-(3-acetamidophenyl)-2-(4-phenoxyanilino)acetamide
CID 54812613
N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide
CID 39912338
1-[2-(2-methylphenyl)ethyl]-3-(4-phenoxyphenyl)urea
CID 108899665
2-[(2-methoxyphenyl)methylamino]-N-[(2-methylphenyl)methyl]acetamide
CID 108996645
N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide
CID 109009860
2-methyl-N-[4-methyl-3-[[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]phenyl]propanamide
CID 60537469
N-[(2-chlorophenyl)methyl]-2-(4-phenylmethoxyanilino)acetamide
CID 54821696
3,3-dimethyl-N-[(2-methylphenyl)methyl]butanamide
CID 110755430
N-(4-phenoxyphenyl)-2-(3,4,5-trimethoxyanilino)acetamide
CID 55362283

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide?
The IUPAC name of N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide (CID 108996702) is N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide.
What is the SMILES notation for N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide?
The canonical SMILES for N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide is Cc1ccccc1CNC(=O)CNc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide?
The InChIKey is PPFCXRFIFJTHGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-17-7-5-6-8-18(17)15-24-22(25)16-23-19-11-13-21(14-12-19)26-20-9-3-2-4-10-20/h2-14,23H,15-16H2,1H3,(H,24,25).
What are the key properties of N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide?
N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide has a molecular weight of 346.43 g/mol, XLogP of 4.52, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylphenyl)methyl]-2-(4-phenoxyanilino)acetamide is sourced from PubChem (CID 108996702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).