2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine

C12H15N5 — CID 124641222

IUPAC2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine
SMILESc1c[nH]c(-c2cncc([C@@H]3CCCNC3)n2)n1
InChIInChI=1S/C12H15N5/c1-2-9(6-13-3-1)10-7-14-8-11(17-10)12-15-4-5-16-12/h4-5,7-9,13H,1-3,6H2,(H,15,16)/t9-/m1/s1
InChIKeyOUTUFPDZFPEORX-SECBINFHSA-N
MW229.29 g/mol
LogP1.33
Rot. Bonds2

About 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine

2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine (PubChem CID 124641222) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine
PubChem CID124641222
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine
SMILESc1c[nH]c(-c2cncc([C@@H]3CCCNC3)n2)n1
InChIInChI=1S/C12H15N5/c1-2-9(6-13-3-1)10-7-14-8-11(17-10)12-15-4-5-16-12/h4-5,7-9,13H,1-3,6H2,(H,15,16)/t9-/m1/s1
InChIKeyOUTUFPDZFPEORX-SECBINFHSA-N
XLogP1.33
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 ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine?
The IUPAC name of 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine (CID 124641222) is 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine?
The canonical SMILES for 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine is c1c[nH]c(-c2cncc([C@@H]3CCCNC3)n2)n1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine?
The InChIKey is OUTUFPDZFPEORX-SECBINFHSA-N. The full InChI is InChI=1S/C12H15N5/c1-2-9(6-13-3-1)10-7-14-8-11(17-10)12-15-4-5-16-12/h4-5,7-9,13H,1-3,6H2,(H,15,16)/t9-/m1/s1.
What are the key properties of 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine?
2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine has a molecular weight of 229.29 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-6-[(3R)-piperidin-3-yl]pyrazine is sourced from PubChem (CID 124641222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).