N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide

C24H22N2O3 — CID 55582792

IUPACN-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide
SMILESCC(NC(=O)COc1ccc(OCc2ccccc2)cc1)c1ccc(C#N)cc1
InChIInChI=1S/C24H22N2O3/c1-18(21-9-7-19(15-25)8-10-21)26-24(27)17-29-23-13-11-22(12-14-23)28-16-20-5-3-2-4-6-20/h2-14,18H,16-17H2,1H3,(H,26,27)
InChIKeyALQPRPAXRNAKPA-UHFFFAOYSA-N
MW386.45 g/mol
LogP4.39
Rot. Bonds8

About N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide

N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide (PubChem CID 55582792) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide
PubChem CID55582792
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC NameN-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide
SMILESCC(NC(=O)COc1ccc(OCc2ccccc2)cc1)c1ccc(C#N)cc1
InChIInChI=1S/C24H22N2O3/c1-18(21-9-7-19(15-25)8-10-21)26-24(27)17-29-23-13-11-22(12-14-23)28-16-20-5-3-2-4-6-20/h2-14,18H,16-17H2,1H3,(H,26,27)
InChIKeyALQPRPAXRNAKPA-UHFFFAOYSA-N
XLogP4.39
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)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-(4-cyanophenoxy)-N-[(1S)-1-phenylethyl]acetamide
CID 2711808
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7671146
2-(4-cyanophenoxy)-N-[1-(4-methylsulfonylphenyl)ethyl]acetamide
CID 51247133
2-(4-cyanophenoxy)-N-(4-phenylbutan-2-yl)acetamide
CID 3593728
2-(4-cyanophenoxy)-N-[1-(1H-pyrazol-4-yl)ethyl]acetamide
CID 103856270
2-(4-cyanophenoxy)-N-(1-pyridin-3-ylethyl)acetamide
CID 43396288
N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-cyanophenoxy)acetamide
CID 7503511
N-[1-(4-ethylphenyl)ethyl]-2-phenoxyacetamide
CID 17326821
(2R)-2-[[2-(4-cyanophenoxy)acetyl]amino]propanoic acid
CID 54990947
2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 836085
N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide
CID 42902003
4-[1-(4-phenylmethoxyphenyl)ethoxy]benzonitrile
CID 19918506

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide?
The IUPAC name of N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide (CID 55582792) is N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide.
What is the SMILES notation for N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide?
The canonical SMILES for N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide is CC(NC(=O)COc1ccc(OCc2ccccc2)cc1)c1ccc(C#N)cc1.
What is the InChIKey of N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide?
The InChIKey is ALQPRPAXRNAKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-18(21-9-7-19(15-25)8-10-21)26-24(27)17-29-23-13-11-22(12-14-23)28-16-20-5-3-2-4-6-20/h2-14,18H,16-17H2,1H3,(H,26,27).
What are the key properties of N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide?
N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide has a molecular weight of 386.45 g/mol, XLogP of 4.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-cyanophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide is sourced from PubChem (CID 55582792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).