2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide

C19H18N4O — CID 175794373

IUPAC2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide
SMILESCC(Nc1cncc(-c2ccccc2)n1)c1ccccc1C(N)=O
InChIInChI=1S/C19H18N4O/c1-13(15-9-5-6-10-16(15)19(20)24)22-18-12-21-11-17(23-18)14-7-3-2-4-8-14/h2-13H,1H3,(H2,20,24)(H,22,23)
InChIKeyPIZKHJDAASSIJL-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.42
Rot. Bonds5

About 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide

2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide (PubChem CID 175794373) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide.

Molecular Properties

Compound Name2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide
PubChem CID175794373
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide
SMILESCC(Nc1cncc(-c2ccccc2)n1)c1ccccc1C(N)=O
InChIInChI=1S/C19H18N4O/c1-13(15-9-5-6-10-16(15)19(20)24)22-18-12-21-11-17(23-18)14-7-3-2-4-8-14/h2-13H,1H3,(H2,20,24)(H,22,23)
InChIKeyPIZKHJDAASSIJL-UHFFFAOYSA-N
XLogP3.42
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide?
The IUPAC name of 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide (CID 175794373) is 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide.
What is the SMILES notation for 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide?
The canonical SMILES for 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide is CC(Nc1cncc(-c2ccccc2)n1)c1ccccc1C(N)=O.
What is the InChIKey of 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide?
The InChIKey is PIZKHJDAASSIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c1-13(15-9-5-6-10-16(15)19(20)24)22-18-12-21-11-17(23-18)14-7-3-2-4-8-14/h2-13H,1H3,(H2,20,24)(H,22,23).
What are the key properties of 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide?
2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide has a molecular weight of 318.38 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(6-phenylpyrazin-2-yl)amino]ethyl]benzamide is sourced from PubChem (CID 175794373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).