N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide

C19H17N3O — CID 10851965

IUPACN-(3-benzyl-5-phenylpyrazin-2-yl)acetamide
SMILESCC(=O)Nc1ncc(-c2ccccc2)nc1Cc1ccccc1
InChIInChI=1S/C19H17N3O/c1-14(23)21-19-17(12-15-8-4-2-5-9-15)22-18(13-20-19)16-10-6-3-7-11-16/h2-11,13H,12H2,1H3,(H,20,21,23)
InChIKeyXDDADFXLUBDNOC-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.69
Rot. Bonds4

About N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide

N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide (PubChem CID 10851965) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-benzyl-5-phenylpyrazin-2-yl)acetamide
PubChem CID10851965
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-(3-benzyl-5-phenylpyrazin-2-yl)acetamide
SMILESCC(=O)Nc1ncc(-c2ccccc2)nc1Cc1ccccc1
InChIInChI=1S/C19H17N3O/c1-14(23)21-19-17(12-15-8-4-2-5-9-15)22-18(13-20-19)16-10-6-3-7-11-16/h2-11,13H,12H2,1H3,(H,20,21,23)
InChIKeyXDDADFXLUBDNOC-UHFFFAOYSA-N
XLogP3.69
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide?
The IUPAC name of N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide (CID 10851965) is N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide.
What is the SMILES notation for N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide?
The canonical SMILES for N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide is CC(=O)Nc1ncc(-c2ccccc2)nc1Cc1ccccc1.
What is the InChIKey of N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide?
The InChIKey is XDDADFXLUBDNOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-14(23)21-19-17(12-15-8-4-2-5-9-15)22-18(13-20-19)16-10-6-3-7-11-16/h2-11,13H,12H2,1H3,(H,20,21,23).
What are the key properties of N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide?
N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide has a molecular weight of 303.37 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzyl-5-phenylpyrazin-2-yl)acetamide is sourced from PubChem (CID 10851965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).