morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone

C19H29N5O2 — CID 56865621

IUPACmorpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone
SMILESO=C(C1CCCN(C2CCN(c3cnccn3)CC2)C1)N1CCOCC1
InChIInChI=1S/C19H29N5O2/c25-19(23-10-12-26-13-11-23)16-2-1-7-24(15-16)17-3-8-22(9-4-17)18-14-20-5-6-21-18/h5-6,14,16-17H,1-4,7-13,15H2
InChIKeyPMAHMGDFLPUSBM-UHFFFAOYSA-N
MW359.47 g/mol
LogP1.02
Rot. Bonds3

About morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone

morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone (PubChem CID 56865621) has the molecular formula C19H29N5O2 and a molecular weight of 359.47 g/mol. Its IUPAC name is morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone
PubChem CID56865621
Molecular FormulaC19H29N5O2
Molecular Weight359.47 g/mol
Exact Mass359.23
IUPAC Namemorpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone
SMILESO=C(C1CCCN(C2CCN(c3cnccn3)CC2)C1)N1CCOCC1
InChIInChI=1S/C19H29N5O2/c25-19(23-10-12-26-13-11-23)16-2-1-7-24(15-16)17-3-8-22(9-4-17)18-14-20-5-6-21-18/h5-6,14,16-17H,1-4,7-13,15H2
InChIKeyPMAHMGDFLPUSBM-UHFFFAOYSA-N
XLogP1.02
TPSA61.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone (CID 56865621) is morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone is O=C(C1CCCN(C2CCN(c3cnccn3)CC2)C1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone?
The InChIKey is PMAHMGDFLPUSBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O2/c25-19(23-10-12-26-13-11-23)16-2-1-7-24(15-16)17-3-8-22(9-4-17)18-14-20-5-6-21-18/h5-6,14,16-17H,1-4,7-13,15H2.
What are the key properties of morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone?
morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone has a molecular weight of 359.47 g/mol, XLogP of 1.02, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[1-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone is sourced from PubChem (CID 56865621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).