[3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone

C19H20N6O — CID 110110209

IUPAC[3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
SMILESCn1cncc1-c1cncc(C2CCCN(C(=O)c3ccccn3)C2)n1
InChIInChI=1S/C19H20N6O/c1-24-13-21-11-18(24)17-10-20-9-16(23-17)14-5-4-8-25(12-14)19(26)15-6-2-3-7-22-15/h2-3,6-7,9-11,13-14H,4-5,8,12H2,1H3
InChIKeyJODPDDISCXFRCL-UHFFFAOYSA-N
MW348.41 g/mol
LogP2.29
Rot. Bonds3

About [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone

[3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone (PubChem CID 110110209) has the molecular formula C19H20N6O and a molecular weight of 348.41 g/mol. Its IUPAC name is [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone.

Molecular Properties

Compound Name[3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
PubChem CID110110209
Molecular FormulaC19H20N6O
Molecular Weight348.41 g/mol
Exact Mass348.17
IUPAC Name[3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
SMILESCn1cncc1-c1cncc(C2CCCN(C(=O)c3ccccn3)C2)n1
InChIInChI=1S/C19H20N6O/c1-24-13-21-11-18(24)17-10-20-9-16(23-17)14-5-4-8-25(12-14)19(26)15-6-2-3-7-22-15/h2-3,6-7,9-11,13-14H,4-5,8,12H2,1H3
InChIKeyJODPDDISCXFRCL-UHFFFAOYSA-N
XLogP2.29
TPSA76.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[3-[6-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 110095314
[(3R)-3-[6-(3-methylphenyl)pyrazin-2-yl]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95819758
[(3S)-3-[6-(pyrazin-2-ylamino)-2-pyridinyl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 124982023
[3-[6-(1-methylimidazol-2-yl)pyrazin-2-yl]piperidin-1-yl]-phenylmethanone
CID 110099957
[(3S)-3-[6-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-phenylmethanone
CID 124976879
[3-(5-methylsulfonyl-2-pyridin-2-ylpyrimidin-4-yl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 110214384
[(3R)-3-[3-(2,3-dimethylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 124999728
[3-(6-methyl-4-phenyl-2-pyridinyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 110091917
[3-(3-methylphenyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 70706897
[3-[6-(methylamino)-2-pyridin-3-ylpyrimidin-4-yl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 110239982
[3-(1-methylbenzimidazol-2-yl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 91947190
(6-methyl-2-pyridinyl)-[(3S)-3-(6-phenoxypyrazin-2-yl)piperidin-1-yl]methanone
CID 124990884

Frequently Asked Questions

What is the IUPAC name of [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone?
The IUPAC name of [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone (CID 110110209) is [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone.
What is the SMILES notation for [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone?
The canonical SMILES for [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone is Cn1cncc1-c1cncc(C2CCCN(C(=O)c3ccccn3)C2)n1.
What is the InChIKey of [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone?
The InChIKey is JODPDDISCXFRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O/c1-24-13-21-11-18(24)17-10-20-9-16(23-17)14-5-4-8-25(12-14)19(26)15-6-2-3-7-22-15/h2-3,6-7,9-11,13-14H,4-5,8,12H2,1H3.
What are the key properties of [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone?
[3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone has a molecular weight of 348.41 g/mol, XLogP of 2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[6-(3-methylimidazol-4-yl)pyrazin-2-yl]piperidin-1-yl]-pyridin-2-ylmethanone is sourced from PubChem (CID 110110209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).