morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone

C18H22N6O2 — CID 109276440

IUPACmorpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone
SMILESO=C(c1cnc(N2CCN(c3ccccn3)CC2)cn1)N1CCOCC1
InChIInChI=1S/C18H22N6O2/c25-18(24-9-11-26-12-10-24)15-13-21-17(14-20-15)23-7-5-22(6-8-23)16-3-1-2-4-19-16/h1-4,13-14H,5-12H2
InChIKeyRCFOTBMNBJXBJC-UHFFFAOYSA-N
MW354.41 g/mol
LogP0.67
Rot. Bonds3

About morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone

morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone (PubChem CID 109276440) has the molecular formula C18H22N6O2 and a molecular weight of 354.41 g/mol. Its IUPAC name is morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone
PubChem CID109276440
Molecular FormulaC18H22N6O2
Molecular Weight354.41 g/mol
Exact Mass354.18
IUPAC Namemorpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone
SMILESO=C(c1cnc(N2CCN(c3ccccn3)CC2)cn1)N1CCOCC1
InChIInChI=1S/C18H22N6O2/c25-18(24-9-11-26-12-10-24)15-13-21-17(14-20-15)23-7-5-22(6-8-23)16-3-1-2-4-19-16/h1-4,13-14H,5-12H2
InChIKeyRCFOTBMNBJXBJC-UHFFFAOYSA-N
XLogP0.67
TPSA74.69 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

(5-morpholin-4-ylpyrazin-2-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 109276621
morpholin-4-yl-[5-(4-phenylpiperazin-1-yl)pyrazin-2-yl]methanone
CID 109276422
(4-methylpiperidin-1-yl)-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone
CID 109275060
[2-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]-morpholin-4-ylmethanone
CID 109365554
morpholin-4-yl-[1-(4-pyridin-2-ylpiperazin-1-yl)isoquinolin-4-yl]methanone
CID 15992231
[2-(morpholine-4-carbonyl)cyclopropyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 109133323
[5-(4-phenylpiperazin-1-yl)pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 109273545
[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 109273565
[4-(6-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 122335131
(4-methylpiperazin-1-yl)-[5-(4-phenylpiperazin-1-yl)pyrazin-2-yl]methanone
CID 109278105
4-[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazine-2-carbonyl]piperazine-1-carbaldehyde
CID 109278769
[6-(oxan-4-yl)pyrimidin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 146078438

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone?
The IUPAC name of morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone (CID 109276440) is morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone?
The canonical SMILES for morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone is O=C(c1cnc(N2CCN(c3ccccn3)CC2)cn1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone?
The InChIKey is RCFOTBMNBJXBJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6O2/c25-18(24-9-11-26-12-10-24)15-13-21-17(14-20-15)23-7-5-22(6-8-23)16-3-1-2-4-19-16/h1-4,13-14H,5-12H2.
What are the key properties of morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone?
morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone has a molecular weight of 354.41 g/mol, XLogP of 0.67, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone is sourced from PubChem (CID 109276440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).