(5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate

C22H22N4O2 — CID 69335650

IUPAC(5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate
SMILESO=C(NN1CCCCC1)Oc1cnc(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C22H22N4O2/c27-22(25-26-14-8-3-9-15-26)28-19-16-23-20(17-10-4-1-5-11-17)21(24-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,25,27)
InChIKeyVSZGLEJEPPDONG-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.30
Rot. Bonds4

About (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate

(5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate (PubChem CID 69335650) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate.

Molecular Properties

Compound Name(5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate
PubChem CID69335650
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC Name(5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate
SMILESO=C(NN1CCCCC1)Oc1cnc(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C22H22N4O2/c27-22(25-26-14-8-3-9-15-26)28-19-16-23-20(17-10-4-1-5-11-17)21(24-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,25,27)
InChIKeyVSZGLEJEPPDONG-UHFFFAOYSA-N
XLogP4.30
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate?
The IUPAC name of (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate (CID 69335650) is (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate.
What is the SMILES notation for (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate?
The canonical SMILES for (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate is O=C(NN1CCCCC1)Oc1cnc(-c2ccccc2)c(-c2ccccc2)n1.
What is the InChIKey of (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate?
The InChIKey is VSZGLEJEPPDONG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c27-22(25-26-14-8-3-9-15-26)28-19-16-23-20(17-10-4-1-5-11-17)21(24-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,25,27).
What are the key properties of (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate?
(5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate has a molecular weight of 374.44 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5,6-diphenylpyrazin-2-yl) N-piperidin-1-ylcarbamate is sourced from PubChem (CID 69335650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).