2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine

C20H24N6 — CID 95810910

IUPAC2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine
SMILESCCc1nccn1-c1nccnc1C1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C20H24N6/c1-2-18-22-11-14-26(18)20-19(23-9-10-24-20)16-6-12-25(13-7-16)15-17-5-3-4-8-21-17/h3-5,8-11,14,16H,2,6-7,12-13,15H2,1H3
InChIKeyHZMDXIVQOURJPM-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.00
Rot. Bonds5

About 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine

2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine (PubChem CID 95810910) has the molecular formula C20H24N6 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine.

Molecular Properties

Compound Name2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine
PubChem CID95810910
Molecular FormulaC20H24N6
Molecular Weight348.45 g/mol
Exact Mass348.21
IUPAC Name2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine
SMILESCCc1nccn1-c1nccnc1C1CCN(Cc2ccccn2)CC1
InChIInChI=1S/C20H24N6/c1-2-18-22-11-14-26(18)20-19(23-9-10-24-20)16-6-12-25(13-7-16)15-17-5-3-4-8-21-17/h3-5,8-11,14,16H,2,6-7,12-13,15H2,1H3
InChIKeyHZMDXIVQOURJPM-UHFFFAOYSA-N
XLogP3.00
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-3-yl]pyrazine
CID 110250066
2-chloro-1-[4-[3-(2-ethylimidazol-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 175657175
1-[4-[3-(2-ethylimidazol-1-yl)pyrazin-2-yl]piperidin-1-yl]-2-pyridin-4-ylethanone
CID 95810981
2-[(4-pyridin-4-ylpiperidin-1-yl)methyl]pyridine
CID 16667834
2-[(4-bromopiperidin-1-yl)methyl]pyridine
CID 80680400
2-[(2-ethylazetidin-1-yl)methyl]pyridine
CID 130678024
1-[(3R)-3-[3-(2-ethylimidazol-1-yl)pyrazin-2-yl]piperidin-1-yl]-2-pyridin-3-ylethanone
CID 95810979
2-[[4-(trifluoromethyl)piperidin-1-yl]methyl]pyridine
CID 131703770
1-[1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]ethanamine
CID 112630112
phenyl-[1-(pyridin-2-ylmethyl)piperidin-4-yl]methanol
CID 110906747
4-methyl-2-[(3R)-1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]pyrimidine
CID 124999909
2-(2-ethylimidazol-1-yl)-6-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]pyridine
CID 95838605

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine?
The IUPAC name of 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine (CID 95810910) is 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine.
What is the SMILES notation for 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine?
The canonical SMILES for 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine is CCc1nccn1-c1nccnc1C1CCN(Cc2ccccn2)CC1.
What is the InChIKey of 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine?
The InChIKey is HZMDXIVQOURJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6/c1-2-18-22-11-14-26(18)20-19(23-9-10-24-20)16-6-12-25(13-7-16)15-17-5-3-4-8-21-17/h3-5,8-11,14,16H,2,6-7,12-13,15H2,1H3.
What are the key properties of 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine?
2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine has a molecular weight of 348.45 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylimidazol-1-yl)-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrazine is sourced from PubChem (CID 95810910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).