3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine

C21H20N4 — CID 22725010

IUPAC3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine
SMILESNN1C=C(c2ccccc2)Nc2nc(CCc3ccccc3)ccc21
InChIInChI=1S/C21H20N4/c22-25-15-19(17-9-5-2-6-10-17)24-21-20(25)14-13-18(23-21)12-11-16-7-3-1-4-8-16/h1-10,13-15H,11-12,22H2,(H,23,24)
InChIKeyWIEHQFAWHHGFPZ-UHFFFAOYSA-N
MW328.42 g/mol
LogP3.97
Rot. Bonds4

About 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine

3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine (PubChem CID 22725010) has the molecular formula C21H20N4 and a molecular weight of 328.42 g/mol. Its IUPAC name is 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine.

Molecular Properties

Compound Name3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine
PubChem CID22725010
Molecular FormulaC21H20N4
Molecular Weight328.42 g/mol
Exact Mass328.17
IUPAC Name3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine
SMILESNN1C=C(c2ccccc2)Nc2nc(CCc3ccccc3)ccc21
InChIInChI=1S/C21H20N4/c22-25-15-19(17-9-5-2-6-10-17)24-21-20(25)14-13-18(23-21)12-11-16-7-3-1-4-8-16/h1-10,13-15H,11-12,22H2,(H,23,24)
InChIKeyWIEHQFAWHHGFPZ-UHFFFAOYSA-N
XLogP3.97
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine?
The IUPAC name of 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine (CID 22725010) is 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine.
What is the SMILES notation for 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine?
The canonical SMILES for 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine is NN1C=C(c2ccccc2)Nc2nc(CCc3ccccc3)ccc21.
What is the InChIKey of 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine?
The InChIKey is WIEHQFAWHHGFPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4/c22-25-15-19(17-9-5-2-6-10-17)24-21-20(25)14-13-18(23-21)12-11-16-7-3-1-4-8-16/h1-10,13-15H,11-12,22H2,(H,23,24).
What are the key properties of 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine?
3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine has a molecular weight of 328.42 g/mol, XLogP of 3.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-6-(2-phenylethyl)-4H-pyrido[2,3-b]pyrazin-1-amine is sourced from PubChem (CID 22725010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).