2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide

C20H19N3O — CID 29029737

IUPAC2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)NCCc1cnccn1
InChIInChI=1S/C20H19N3O/c24-20(23-11-10-19-15-21-12-13-22-19)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9,12-13,15H,10-11,14H2,(H,23,24)
InChIKeyHMUAJLAQEFPLFJ-UHFFFAOYSA-N
MW317.39 g/mol
LogP3.05
Rot. Bonds6

About 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide

2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide (PubChem CID 29029737) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide
PubChem CID29029737
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC Name2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide
SMILESO=C(Cc1ccc(-c2ccccc2)cc1)NCCc1cnccn1
InChIInChI=1S/C20H19N3O/c24-20(23-11-10-19-15-21-12-13-22-19)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9,12-13,15H,10-11,14H2,(H,23,24)
InChIKeyHMUAJLAQEFPLFJ-UHFFFAOYSA-N
XLogP3.05
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide?
The IUPAC name of 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide (CID 29029737) is 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide.
What is the SMILES notation for 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide?
The canonical SMILES for 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide is O=C(Cc1ccc(-c2ccccc2)cc1)NCCc1cnccn1.
What is the InChIKey of 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide?
The InChIKey is HMUAJLAQEFPLFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c24-20(23-11-10-19-15-21-12-13-22-19)14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9,12-13,15H,10-11,14H2,(H,23,24).
What are the key properties of 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide?
2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide has a molecular weight of 317.39 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide is sourced from PubChem (CID 29029737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).