2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine

C11H13N5 — CID 129406977

IUPAC2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine
SMILESc1c[nH]c(-c2nccnc2[C@@H]2CCCN2)n1
InChIInChI=1S/C11H13N5/c1-2-8(12-3-1)9-10(14-5-4-13-9)11-15-6-7-16-11/h4-8,12H,1-3H2,(H,15,16)/t8-/m0/s1
InChIKeyCHLYLKGXIPHUBY-QMMMGPOBSA-N
MW215.26 g/mol
LogP1.29
Rot. Bonds2

About 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine

2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine (PubChem CID 129406977) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine
PubChem CID129406977
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC Name2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine
SMILESc1c[nH]c(-c2nccnc2[C@@H]2CCCN2)n1
InChIInChI=1S/C11H13N5/c1-2-8(12-3-1)9-10(14-5-4-13-9)11-15-6-7-16-11/h4-8,12H,1-3H2,(H,15,16)/t8-/m0/s1
InChIKeyCHLYLKGXIPHUBY-QMMMGPOBSA-N
XLogP1.29
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1H-imidazol-2-yl)-3-piperidin-4-ylpyrazine
CID 110099974
2-(1H-imidazol-2-yl)-5-pyrrolidin-2-ylpyrazine
CID 132648027
3-(1H-imidazol-2-yl)-5-[(2R)-pyrrolidin-2-yl]-1,2,4-oxadiazole
CID 136746255
[2-[3-(1H-imidazol-2-yl)pyrazin-2-yl]pyrrolidin-1-yl]-phenylmethanone
CID 110099808
2-[(2S)-pyrrolidin-2-yl]-1H-imidazole;2,2,2-trifluoroacetic acid
CID 172788973
3-phenyl-2-pyrrolidin-2-ylpyridine
CID 115008660
(2-pyrrolidin-2-yl-3-pyridinyl)boronic acid
CID 121234044
2-(3-methyl-2-pyridinyl)azepane
CID 81148387
tris(2-(1H-imidazol-2-yl)-1H-imidazole);ruthenium
CID 20805474
2-[(2R)-pyrrolidin-2-yl]pyridine
CID 7141590
2-[(2R)-pyrrolidin-2-yl]-1,3-thiazole
CID 7047975
6-[[4-[3-(1H-imidazol-2-yl)pyrazin-2-yl]piperidin-1-yl]methyl]-1H-indole
CID 110110865

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine?
The IUPAC name of 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine (CID 129406977) is 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine?
The canonical SMILES for 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine is c1c[nH]c(-c2nccnc2[C@@H]2CCCN2)n1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine?
The InChIKey is CHLYLKGXIPHUBY-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H13N5/c1-2-8(12-3-1)9-10(14-5-4-13-9)11-15-6-7-16-11/h4-8,12H,1-3H2,(H,15,16)/t8-/m0/s1.
What are the key properties of 2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine?
2-(1H-imidazol-2-yl)-3-[(2S)-pyrrolidin-2-yl]pyrazine has a molecular weight of 215.26 g/mol, XLogP of 1.29, 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)-3-[(2S)-pyrrolidin-2-yl]pyrazine is sourced from PubChem (CID 129406977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).