2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine

C17H25N5 — CID 125005520

IUPAC2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine
SMILESCc1ncc(-c2cncc([C@@H]3CCCN(C(C)C)C3)n2)n1C
InChIInChI=1S/C17H25N5/c1-12(2)22-7-5-6-14(11-22)15-8-18-9-16(20-15)17-10-19-13(3)21(17)4/h8-10,12,14H,5-7,11H2,1-4H3/t14-/m1/s1
InChIKeyTZWGQDJMPWESTL-CQSZACIVSA-N
MW299.42 g/mol
LogP2.77
Rot. Bonds3

About 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine

2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine (PubChem CID 125005520) has the molecular formula C17H25N5 and a molecular weight of 299.42 g/mol. Its IUPAC name is 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine.

Molecular Properties

Compound Name2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine
PubChem CID125005520
Molecular FormulaC17H25N5
Molecular Weight299.42 g/mol
Exact Mass299.21
IUPAC Name2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine
SMILESCc1ncc(-c2cncc([C@@H]3CCCN(C(C)C)C3)n2)n1C
InChIInChI=1S/C17H25N5/c1-12(2)22-7-5-6-14(11-22)15-8-18-9-16(20-15)17-10-19-13(3)21(17)4/h8-10,12,14H,5-7,11H2,1-4H3/t14-/m1/s1
InChIKeyTZWGQDJMPWESTL-CQSZACIVSA-N
XLogP2.77
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[(3S)-3-[6-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-phenylmethanone
CID 124976879
5-[6-[(3S)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-thiazole
CID 125023963
N-methyl-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-amine
CID 124964857
[3-[6-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 110095314
N,N-dimethyl-6-(1-propan-2-ylpiperidin-3-yl)pyrazin-2-amine
CID 73440428
2-(2-methylpropyl)-5-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-thiazole
CID 124974214
2-(2-methylpropyl)-5-[6-(1-propan-2-ylpiperidin-3-yl)pyrazin-2-yl]-1,3-thiazole
CID 110130923
[(3R)-3-[6-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-(3-fluorophenyl)methanone
CID 125021197
2-(2,3-dimethylimidazol-4-yl)-5-[(1-propan-2-ylpiperidin-3-yl)methyl]pyrazine
CID 110130970
1-[3-[6-(2,3-dimethylimidazol-4-yl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 110130884
2-[(3S)-1-propan-2-ylpiperidin-3-yl]-6-pyridin-3-yloxypyrazine
CID 95821868
3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one
CID 124977703

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine?
The IUPAC name of 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine (CID 125005520) is 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine.
What is the SMILES notation for 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine?
The canonical SMILES for 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine is Cc1ncc(-c2cncc([C@@H]3CCCN(C(C)C)C3)n2)n1C.
What is the InChIKey of 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine?
The InChIKey is TZWGQDJMPWESTL-CQSZACIVSA-N. The full InChI is InChI=1S/C17H25N5/c1-12(2)22-7-5-6-14(11-22)15-8-18-9-16(20-15)17-10-19-13(3)21(17)4/h8-10,12,14H,5-7,11H2,1-4H3/t14-/m1/s1.
What are the key properties of 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine?
2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine has a molecular weight of 299.42 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine is sourced from PubChem (CID 125005520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).