N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide

C25H24N2O2 — CID 7671061

IUPACN-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
SMILESCCCCc1ccc(NC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cc1
InChIInChI=1S/C25H24N2O2/c1-2-3-4-19-7-13-23(14-8-19)27-25(28)18-29-24-15-11-22(12-16-24)21-9-5-20(17-26)6-10-21/h5-16H,2-4,18H2,1H3,(H,27,28)
InChIKeyIPLNDBGUFOWKQV-UHFFFAOYSA-N
MW384.48 g/mol
LogP5.59
Rot. Bonds8

About N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide

N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide (PubChem CID 7671061) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
PubChem CID7671061
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC NameN-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
SMILESCCCCc1ccc(NC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cc1
InChIInChI=1S/C25H24N2O2/c1-2-3-4-19-7-13-23(14-8-19)27-25(28)18-29-24-15-11-22(12-16-24)21-9-5-20(17-26)6-10-21/h5-16H,2-4,18H2,1H3,(H,27,28)
InChIKeyIPLNDBGUFOWKQV-UHFFFAOYSA-N
XLogP5.59
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.48
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]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-(4-cyanophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7966728
N-(4-bromophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 3473577
N-(4-butylphenyl)-2-(4-formylphenoxy)acetamide
CID 23409214
N-(4-butylphenyl)-2-(4-propanoylphenoxy)acetamide
CID 7788208
methyl 4-[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]benzoate
CID 1034299
N-[4-[(2S)-butan-2-yl]phenyl]-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7671033
2-[4-(cyanomethyl)phenoxy]-N-(4-cyanophenyl)acetamide
CID 43824284
N-(4-cyanophenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61027849
2-[4-(4-cyanophenyl)phenoxy]-N-hexadecylacetamide
CID 3468682
4-butyl-N-[4-(4-cyanophenoxy)phenyl]benzamide
CID 44723465
N-(4-bromophenyl)-2-(4-cyanophenoxy)acetamide
CID 7818711
2-[4-(4-cyanophenyl)phenoxy]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 18230254

Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide?
The IUPAC name of N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide (CID 7671061) is N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide.
What is the SMILES notation for N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide?
The canonical SMILES for N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide is CCCCc1ccc(NC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cc1.
What is the InChIKey of N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide?
The InChIKey is IPLNDBGUFOWKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c1-2-3-4-19-7-13-23(14-8-19)27-25(28)18-29-24-15-11-22(12-16-24)21-9-5-20(17-26)6-10-21/h5-16H,2-4,18H2,1H3,(H,27,28).
What are the key properties of N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide?
N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide has a molecular weight of 384.48 g/mol, XLogP of 5.59, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butylphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide is sourced from PubChem (CID 7671061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).