2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine

C20H23N5 — CID 110267837

IUPAC2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine
SMILESCCc1nccn1-c1cncc(C2CCCN2Cc2ccccc2)n1
InChIInChI=1S/C20H23N5/c1-2-19-22-10-12-25(19)20-14-21-13-17(23-20)18-9-6-11-24(18)15-16-7-4-3-5-8-16/h3-5,7-8,10,12-14,18H,2,6,9,11,15H2,1H3
InChIKeyVBOUGGBPGJGUSF-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.56
Rot. Bonds5

About 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine

2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine (PubChem CID 110267837) has the molecular formula C20H23N5 and a molecular weight of 333.44 g/mol. Its IUPAC name is 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine.

Molecular Properties

Compound Name2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine
PubChem CID110267837
Molecular FormulaC20H23N5
Molecular Weight333.44 g/mol
Exact Mass333.20
IUPAC Name2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine
SMILESCCc1nccn1-c1cncc(C2CCCN2Cc2ccccc2)n1
InChIInChI=1S/C20H23N5/c1-2-19-22-10-12-25(19)20-14-21-13-17(23-20)18-9-6-11-24(18)15-16-7-4-3-5-8-16/h3-5,7-8,10,12-14,18H,2,6,9,11,15H2,1H3
InChIKeyVBOUGGBPGJGUSF-UHFFFAOYSA-N
XLogP3.56
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethylimidazol-1-yl)-6-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyrazine
CID 95838557
2-(2-ethylimidazol-1-yl)-6-[(2R)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]pyrazine
CID 95838571
2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyridine
CID 110268024
1-[(2S)-2-[6-(2-ethylimidazol-1-yl)pyrazin-2-yl]pyrrolidin-1-yl]-2-phenylethanone
CID 95838357
1-[(2R)-2-[6-(2-ethylimidazol-1-yl)pyrazin-2-yl]pyrrolidin-1-yl]-2-pyridin-3-ylethanone
CID 95838496
[(2S)-2-[6-(2-ethylimidazol-1-yl)pyrazin-2-yl]pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 95838332
cyclobutyl-[2-[6-(2-ethylimidazol-1-yl)pyrazin-2-yl]pyrrolidin-1-yl]methanone
CID 110267761
2-(2-ethylimidazol-1-yl)-6-[(2R)-1-(3-phenylpropyl)pyrrolidin-2-yl]pyridine
CID 95839027
2-[(2S)-2-[6-(2-ethylimidazol-1-yl)pyrazin-2-yl]pyrrolidin-1-yl]-1-morpholin-4-ylethanone
CID 95838647
2-(2-ethylimidazol-1-yl)-6-[(2R)-1-(thiophen-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95815941
[(3S)-3-[6-(2-ethylimidazol-1-yl)pyrazin-2-yl]piperidin-1-yl]-phenylmethanone
CID 95815602
2-(2-ethylimidazol-1-yl)-6-[(3R)-1-[(4-fluorophenyl)methyl]piperidin-3-yl]pyrazine
CID 95815716

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine?
The IUPAC name of 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine (CID 110267837) is 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine.
What is the SMILES notation for 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine?
The canonical SMILES for 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine is CCc1nccn1-c1cncc(C2CCCN2Cc2ccccc2)n1.
What is the InChIKey of 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine?
The InChIKey is VBOUGGBPGJGUSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5/c1-2-19-22-10-12-25(19)20-14-21-13-17(23-20)18-9-6-11-24(18)15-16-7-4-3-5-8-16/h3-5,7-8,10,12-14,18H,2,6,9,11,15H2,1H3.
What are the key properties of 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine?
2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine has a molecular weight of 333.44 g/mol, XLogP of 3.56, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyrazine is sourced from PubChem (CID 110267837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).