2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine

C18H25N5 — CID 110250031

IUPAC2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine
SMILESCc1nccn1-c1nccnc1C1CCCN(C2CCCC2)C1
InChIInChI=1S/C18H25N5/c1-14-19-10-12-23(14)18-17(20-8-9-21-18)15-5-4-11-22(13-15)16-6-2-3-7-16/h8-10,12,15-16H,2-7,11,13H2,1H3
InChIKeyRISBGLGIOYKMHN-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.09
Rot. Bonds3

About 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine

2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine (PubChem CID 110250031) has the molecular formula C18H25N5 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine.

Molecular Properties

Compound Name2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine
PubChem CID110250031
Molecular FormulaC18H25N5
Molecular Weight311.43 g/mol
Exact Mass311.21
IUPAC Name2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine
SMILESCc1nccn1-c1nccnc1C1CCCN(C2CCCC2)C1
InChIInChI=1S/C18H25N5/c1-14-19-10-12-23(14)18-17(20-8-9-21-18)15-5-4-11-22(13-15)16-6-2-3-7-16/h8-10,12,15-16H,2-7,11,13H2,1H3
InChIKeyRISBGLGIOYKMHN-UHFFFAOYSA-N
XLogP3.09
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(3R)-1-azabicyclo[2.2.1]heptan-3-yl]-N,N-dimethylpyrazin-2-amine
CID 71452694
6-[(3S)-1-azabicyclo[2.2.1]heptan-3-yl]-N,N-dimethylpyrazin-2-amine
CID 71459875
2-Imidazol-1-yl-6-piperidin-4-ylpyrazine
CID 95804707
1-[4-[(5-Imidazol-1-ylpyrazin-2-yl)methyl]piperidin-1-yl]ethanone
CID 95825000
N-[(1-methylimidazol-2-yl)methyl]-5-(1-methylpiperidin-4-yl)pyrazin-2-amine
CID 95825616
2-Imidazol-1-yl-5-piperidin-4-ylpyrazine
CID 95846357
2-(2-Methylimidazol-1-yl)-3-(1-methylpiperidin-3-yl)pyrazine
CID 110250038
2-Imidazol-1-yl-3-[1-(oxan-4-yl)piperidin-3-yl]pyrazine
CID 110250111
2-(1-Cyclopentylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine
CID 110253558
2-(1-Cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine
CID 110253561
N,N-dimethyl-3-(1-pyrazin-2-ylpiperidin-3-yl)pyrazin-2-amine
CID 110254098
N,N-dimethyl-6-(1-pyrazin-2-ylpiperidin-3-yl)pyrazin-2-amine
CID 110254100

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine?
The IUPAC name of 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine (CID 110250031) is 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine.
What is the SMILES notation for 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine?
The canonical SMILES for 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine is Cc1nccn1-c1nccnc1C1CCCN(C2CCCC2)C1.
What is the InChIKey of 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine?
The InChIKey is RISBGLGIOYKMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5/c1-14-19-10-12-23(14)18-17(20-8-9-21-18)15-5-4-11-22(13-15)16-6-2-3-7-16/h8-10,12,15-16H,2-7,11,13H2,1H3.
What are the key properties of 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine?
2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine has a molecular weight of 311.43 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylpiperidin-3-yl)-3-(2-methylimidazol-1-yl)pyrazine is sourced from PubChem (CID 110250031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).