2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine

C19H23N7 — CID 125004932

IUPAC2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine
SMILESCc1ncc(-c2nccnc2C[C@H]2CCCN(c3cnccn3)C2)n1C
InChIInChI=1S/C19H23N7/c1-14-24-11-17(25(14)2)19-16(21-7-8-23-19)10-15-4-3-9-26(13-15)18-12-20-5-6-22-18/h5-8,11-12,15H,3-4,9-10,13H2,1-2H3/t15-/m1/s1
InChIKeyTVXSWIGKYIZMLK-OAHLLOKOSA-N
MW349.44 g/mol
LogP2.43
Rot. Bonds4

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

2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine (PubChem CID 125004932) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine.

Molecular Properties

Compound Name2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine
PubChem CID125004932
Molecular FormulaC19H23N7
Molecular Weight349.44 g/mol
Exact Mass349.20
IUPAC Name2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine
SMILESCc1ncc(-c2nccnc2C[C@H]2CCCN(c3cnccn3)C2)n1C
InChIInChI=1S/C19H23N7/c1-14-24-11-17(25(14)2)19-16(21-7-8-23-19)10-15-4-3-9-26(13-15)18-12-20-5-6-22-18/h5-8,11-12,15H,3-4,9-10,13H2,1-2H3/t15-/m1/s1
InChIKeyTVXSWIGKYIZMLK-OAHLLOKOSA-N
XLogP2.43
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine with MolForge

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Related Compounds

2-(2,3-dimethylimidazol-4-yl)-3-[[1-(2-methylpyrimidin-4-yl)piperidin-3-yl]methyl]pyrazine
CID 110100546
N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
CID 110095072
1-[(3S)-3-[[3-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]methyl]piperidin-1-yl]ethanone
CID 124961929
N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
CID 110095070
2-[(3R)-3-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
CID 95840910
2-[(3S)-3-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
CID 95840909
2-(3-ethylpiperidin-1-yl)pyrazine
CID 146424567
1-[3-[[3-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]methyl]pyrrolidin-1-yl]-2,2-dimethylpropan-1-one
CID 110131850
2-[3-(bromomethyl)piperidin-1-yl]pyrazine
CID 80674587
N-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]propan-1-amine
CID 62586883
(3S)-1-pyrazin-2-ylpiperidin-3-amine
CID 86277059
(3S)-N-methyl-1-pyrazin-2-ylpiperidin-3-amine
CID 94476433

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine?
The IUPAC name of 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine (CID 125004932) is 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine.
What is the SMILES notation for 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine?
The canonical SMILES for 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine is Cc1ncc(-c2nccnc2C[C@H]2CCCN(c3cnccn3)C2)n1C.
What is the InChIKey of 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine?
The InChIKey is TVXSWIGKYIZMLK-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H23N7/c1-14-24-11-17(25(14)2)19-16(21-7-8-23-19)10-15-4-3-9-26(13-15)18-12-20-5-6-22-18/h5-8,11-12,15H,3-4,9-10,13H2,1-2H3/t15-/m1/s1.
What are the key properties of 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine?
2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine has a molecular weight of 349.44 g/mol, XLogP of 2.43, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine is sourced from PubChem (CID 125004932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).