2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine

C13H15N5 — CID 95817336

IUPAC2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine
SMILESc1cc(C2CCN(c3cnccn3)CC2)ncn1
InChIInChI=1S/C13H15N5/c1-4-15-10-17-12(1)11-2-7-18(8-3-11)13-9-14-5-6-16-13/h1,4-6,9-11H,2-3,7-8H2
InChIKeyFJURBQBDNQAGED-UHFFFAOYSA-N
MW241.30 g/mol
LogP1.65
Rot. Bonds2

About 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine

2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine (PubChem CID 95817336) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine
PubChem CID95817336
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC Name2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine
SMILESc1cc(C2CCN(c3cnccn3)CC2)ncn1
InChIInChI=1S/C13H15N5/c1-4-15-10-17-12(1)11-2-7-18(8-3-11)13-9-14-5-6-16-13/h1,4-6,9-11H,2-3,7-8H2
InChIKeyFJURBQBDNQAGED-UHFFFAOYSA-N
XLogP1.65
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine?
The IUPAC name of 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine (CID 95817336) is 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine?
The canonical SMILES for 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine is c1cc(C2CCN(c3cnccn3)CC2)ncn1.
What is the InChIKey of 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine?
The InChIKey is FJURBQBDNQAGED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-4-15-10-17-12(1)11-2-7-18(8-3-11)13-9-14-5-6-16-13/h1,4-6,9-11H,2-3,7-8H2.
What are the key properties of 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine?
2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine has a molecular weight of 241.30 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyrimidin-4-ylpiperidin-1-yl)pyrazine is sourced from PubChem (CID 95817336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).