2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide

C22H22N2O2 — CID 46045417

IUPAC2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccc(NCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H22N2O2/c1-26-21-13-11-20(12-14-21)24-22(25)15-17-7-9-19(10-8-17)23-16-18-5-3-2-4-6-18/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyGPLDITUUCMFQGY-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.49
Rot. Bonds7

About 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide

2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide (PubChem CID 46045417) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide
PubChem CID46045417
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC Name2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccc(NCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H22N2O2/c1-26-21-13-11-20(12-14-21)24-22(25)15-17-7-9-19(10-8-17)23-16-18-5-3-2-4-6-18/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyGPLDITUUCMFQGY-UHFFFAOYSA-N
XLogP4.49
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 ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(4-methoxyphenyl)methylamino]phenyl]-2-phenoxyacetamide
CID 112982725
2-[4-[(3,5-dimethoxyphenyl)methylamino]phenyl]-N-phenylacetamide
CID 42852472
2-(1H-indol-3-yl)-N-[4-[(4-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982718
N-[4-[2-(4-methoxyphenyl)-2-oxoethoxy]phenyl]-2-phenylacetamide
CID 163663430
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
2-phenyl-N-[4-(pyridin-4-ylmethylamino)phenyl]acetamide
CID 112983139
2-[4-[(4-fluorophenyl)methylamino]phenyl]-N-phenylacetamide
CID 42852473
2-(4-methoxyanilino)-N-phenylacetamide
CID 7636829
N-[4-(2-methoxyphenoxy)phenyl]-2-(4-methoxyphenyl)acetamide
CID 27901681
2-[4-[(4-methoxyphenyl)methylamino]phenyl]-N-[(3-methylphenyl)methyl]acetamide
CID 42852652
N'-(4-methoxyphenyl)-N-phenylpropanediamide
CID 15154641
2-(4-methoxyphenyl)-N-[4-(3-methylbutylamino)phenyl]acetamide
CID 112985099

Frequently Asked Questions

What is the IUPAC name of 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide (CID 46045417) is 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)Cc2ccc(NCc3ccccc3)cc2)cc1.
What is the InChIKey of 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide?
The InChIKey is GPLDITUUCMFQGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-26-21-13-11-20(12-14-21)24-22(25)15-17-7-9-19(10-8-17)23-16-18-5-3-2-4-6-18/h2-14,23H,15-16H2,1H3,(H,24,25).
What are the key properties of 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide?
2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide has a molecular weight of 346.43 g/mol, XLogP of 4.49, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(benzylamino)phenyl]-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 46045417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).