2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine

C21H31N5 — CID 110253561

IUPAC2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine
SMILESCC(C)c1nccn1-c1cncc(C2CCCN(C3CCCCC3)C2)n1
InChIInChI=1S/C21H31N5/c1-16(2)21-23-10-12-26(21)20-14-22-13-19(24-20)17-7-6-11-25(15-17)18-8-4-3-5-9-18/h10,12-14,16-18H,3-9,11,15H2,1-2H3
InChIKeyXNVDQWVKMOKSNP-UHFFFAOYSA-N
MW353.51 g/mol
LogP4.30
Rot. Bonds4

About 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine

2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine (PubChem CID 110253561) has the molecular formula C21H31N5 and a molecular weight of 353.51 g/mol. Its IUPAC name is 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine.

Molecular Properties

Compound Name2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine
PubChem CID110253561
Molecular FormulaC21H31N5
Molecular Weight353.51 g/mol
Exact Mass353.26
IUPAC Name2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine
SMILESCC(C)c1nccn1-c1cncc(C2CCCN(C3CCCCC3)C2)n1
InChIInChI=1S/C21H31N5/c1-16(2)21-23-10-12-26(21)20-14-22-13-19(24-20)17-7-6-11-25(15-17)18-8-4-3-5-9-18/h10,12-14,16-18H,3-9,11,15H2,1-2H3
InChIKeyXNVDQWVKMOKSNP-UHFFFAOYSA-N
XLogP4.30
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.51
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(3S)-1-cyclopentylpiperidin-3-yl]-6-(2-propan-2-ylimidazol-1-yl)pyrazine
CID 95815785
2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyridine
CID 110268052
2-(1-cyclopentylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyridine
CID 110268048
1-morpholin-4-yl-2-[(3R)-3-[6-(2-propan-2-ylimidazol-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95815815
2-(2-propan-2-ylimidazol-1-yl)-6-[(2S)-pyrrolidin-2-yl]pyrazine
CID 125011223
cyclopentyl-[3-[6-(2-methylimidazol-1-yl)pyrazin-2-yl]piperidin-1-yl]methanone
CID 110253502
2-(1-cyclopentylpyrrolidin-2-yl)-6-(2-propan-2-ylimidazol-1-yl)pyridine
CID 110268045
[3-[6-(2-propan-2-ylimidazol-1-yl)-2-pyridinyl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 110268069
2-[(3S)-1-cyclohexylpiperidin-3-yl]-6-imidazol-1-ylpyridine
CID 95838629
2-(2-ethylimidazol-1-yl)-6-[(3R)-1-(2-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine
CID 95815880
2-(2-ethylimidazol-1-yl)-6-[(3S)-1-(2-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine
CID 95815881
2-(4-methoxyphenyl)-1-[(2R)-2-[6-(2-propan-2-ylimidazol-1-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone
CID 95838299

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine?
The IUPAC name of 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine (CID 110253561) is 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine.
What is the SMILES notation for 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine?
The canonical SMILES for 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine is CC(C)c1nccn1-c1cncc(C2CCCN(C3CCCCC3)C2)n1.
What is the InChIKey of 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine?
The InChIKey is XNVDQWVKMOKSNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N5/c1-16(2)21-23-10-12-26(21)20-14-22-13-19(24-20)17-7-6-11-25(15-17)18-8-4-3-5-9-18/h10,12-14,16-18H,3-9,11,15H2,1-2H3.
What are the key properties of 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine?
2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine has a molecular weight of 353.51 g/mol, XLogP of 4.30, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylpiperidin-3-yl)-6-(2-propan-2-ylimidazol-1-yl)pyrazine is sourced from PubChem (CID 110253561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).