2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine

C15H21N5 — CID 133273860

IUPAC2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine
SMILESCc1cc(C)n(-c2cncc(N3CCC(C)CC3)n2)n1
InChIInChI=1S/C15H21N5/c1-11-4-6-19(7-5-11)14-9-16-10-15(17-14)20-13(3)8-12(2)18-20/h8-11H,4-7H2,1-3H3
InChIKeySKQIMYJXWJKAOT-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.52
Rot. Bonds2

About 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine

2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine (PubChem CID 133273860) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine
PubChem CID133273860
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine
SMILESCc1cc(C)n(-c2cncc(N3CCC(C)CC3)n2)n1
InChIInChI=1S/C15H21N5/c1-11-4-6-19(7-5-11)14-9-16-10-15(17-14)20-13(3)8-12(2)18-20/h8-11H,4-7H2,1-3H3
InChIKeySKQIMYJXWJKAOT-UHFFFAOYSA-N
XLogP2.52
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine (CID 133273860) is 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine is Cc1cc(C)n(-c2cncc(N3CCC(C)CC3)n2)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine?
The InChIKey is SKQIMYJXWJKAOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-11-4-6-19(7-5-11)14-9-16-10-15(17-14)20-13(3)8-12(2)18-20/h8-11H,4-7H2,1-3H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine?
2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine has a molecular weight of 271.37 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine is sourced from PubChem (CID 133273860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).