2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine

C12H15N5 — CID 175662403

IUPAC2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine
SMILESCc1cnc(-c2cncc(C3CCCN3)n2)[nH]1
InChIInChI=1S/C12H15N5/c1-8-5-15-12(16-8)11-7-13-6-10(17-11)9-3-2-4-14-9/h5-7,9,14H,2-4H2,1H3,(H,15,16)
InChIKeyCYVJDGZDMVWYKV-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.60
Rot. Bonds2

About 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine

2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine (PubChem CID 175662403) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine.

Molecular Properties

Compound Name2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine
PubChem CID175662403
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine
SMILESCc1cnc(-c2cncc(C3CCCN3)n2)[nH]1
InChIInChI=1S/C12H15N5/c1-8-5-15-12(16-8)11-7-13-6-10(17-11)9-3-2-4-14-9/h5-7,9,14H,2-4H2,1H3,(H,15,16)
InChIKeyCYVJDGZDMVWYKV-UHFFFAOYSA-N
XLogP1.60
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine?
The IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine (CID 175662403) is 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine.
What is the SMILES notation for 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine?
The canonical SMILES for 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine is Cc1cnc(-c2cncc(C3CCCN3)n2)[nH]1.
What is the InChIKey of 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine?
The InChIKey is CYVJDGZDMVWYKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-8-5-15-12(16-8)11-7-13-6-10(17-11)9-3-2-4-14-9/h5-7,9,14H,2-4H2,1H3,(H,15,16).
What are the key properties of 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine?
2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine has a molecular weight of 229.29 g/mol, XLogP of 1.60, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-imidazol-2-yl)-6-pyrrolidin-2-ylpyrazine is sourced from PubChem (CID 175662403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).