2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide

C20H18N2O — CID 801778

IUPAC2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)NCc1cccnc1
InChIInChI=1S/C20H18N2O/c23-20(22-15-17-5-4-12-21-14-17)13-16-8-10-19(11-9-16)18-6-2-1-3-7-18/h1-12,14H,13,15H2,(H,22,23)
InChIKeySRUDJIQKKBQOHI-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.61
Rot. Bonds5

About 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide

2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 801778) has the molecular formula C20H18N2O and a molecular weight of 302.38 g/mol. Its IUPAC name is 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide
PubChem CID801778
Molecular FormulaC20H18N2O
Molecular Weight302.38 g/mol
Exact Mass302.14
IUPAC Name2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)NCc1cccnc1
InChIInChI=1S/C20H18N2O/c23-20(22-15-17-5-4-12-21-14-17)13-16-8-10-19(11-9-16)18-6-2-1-3-7-18/h1-12,14H,13,15H2,(H,22,23)
InChIKeySRUDJIQKKBQOHI-UHFFFAOYSA-N
XLogP3.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide (CID 801778) is 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide is O=C(Cc1ccc(-c2ccccc2)cc1)NCc1cccnc1.
What is the InChIKey of 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is SRUDJIQKKBQOHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O/c23-20(22-15-17-5-4-12-21-14-17)13-16-8-10-19(11-9-16)18-6-2-1-3-7-18/h1-12,14H,13,15H2,(H,22,23).
What are the key properties of 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 302.38 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 801778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).