N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide

C26H22N2O2 — CID 4511463

IUPACN-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C26H22N2O2/c29-26(19-30-25-17-11-21(12-18-25)20-7-3-1-4-8-20)28-24-15-13-23(14-16-24)27-22-9-5-2-6-10-22/h1-18,27H,19H2,(H,28,29)
InChIKeyDDBNQZRAIZQKBA-UHFFFAOYSA-N
MW394.47 g/mol
LogP6.11
Rot. Bonds7

About N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide

N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide (PubChem CID 4511463) has the molecular formula C26H22N2O2 and a molecular weight of 394.47 g/mol. Its IUPAC name is N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide
PubChem CID4511463
Molecular FormulaC26H22N2O2
Molecular Weight394.47 g/mol
Exact Mass394.17
IUPAC NameN-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C26H22N2O2/c29-26(19-30-25-17-11-21(12-18-25)20-7-3-1-4-8-20)28-24-15-13-23(14-16-24)27-22-9-5-2-6-10-22/h1-18,27H,19H2,(H,28,29)
InChIKeyDDBNQZRAIZQKBA-UHFFFAOYSA-N
XLogP6.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.47
LogP ≤ 56.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide?
The IUPAC name of N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide (CID 4511463) is N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide.
What is the SMILES notation for N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide?
The canonical SMILES for N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide is O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(Nc2ccccc2)cc1.
What is the InChIKey of N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide?
The InChIKey is DDBNQZRAIZQKBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N2O2/c29-26(19-30-25-17-11-21(12-18-25)20-7-3-1-4-8-20)28-24-15-13-23(14-16-24)27-22-9-5-2-6-10-22/h1-18,27H,19H2,(H,28,29).
What are the key properties of N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide?
N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide has a molecular weight of 394.47 g/mol, XLogP of 6.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide is sourced from PubChem (CID 4511463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).