morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone

C17H21N5O2 — CID 134072230

IUPACmorpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone
SMILESO=C(c1cnc2n1CCN(Cc1ccccn1)C2)N1CCOCC1
InChIInChI=1S/C17H21N5O2/c23-17(21-7-9-24-10-8-21)15-11-19-16-13-20(5-6-22(15)16)12-14-3-1-2-4-18-14/h1-4,11H,5-10,12-13H2
InChIKeySTKAXVQUOVLVMT-UHFFFAOYSA-N
MW327.39 g/mol
LogP0.77
Rot. Bonds3

About morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone

morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone (PubChem CID 134072230) has the molecular formula C17H21N5O2 and a molecular weight of 327.39 g/mol. Its IUPAC name is morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone
PubChem CID134072230
Molecular FormulaC17H21N5O2
Molecular Weight327.39 g/mol
Exact Mass327.17
IUPAC Namemorpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone
SMILESO=C(c1cnc2n1CCN(Cc1ccccn1)C2)N1CCOCC1
InChIInChI=1S/C17H21N5O2/c23-17(21-7-9-24-10-8-21)15-11-19-16-13-20(5-6-22(15)16)12-14-3-1-2-4-18-14/h1-4,11H,5-10,12-13H2
InChIKeySTKAXVQUOVLVMT-UHFFFAOYSA-N
XLogP0.77
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone (CID 134072230) is morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone is O=C(c1cnc2n1CCN(Cc1ccccn1)C2)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone?
The InChIKey is STKAXVQUOVLVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O2/c23-17(21-7-9-24-10-8-21)15-11-19-16-13-20(5-6-22(15)16)12-14-3-1-2-4-18-14/h1-4,11H,5-10,12-13H2.
What are the key properties of morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone?
morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone has a molecular weight of 327.39 g/mol, XLogP of 0.77, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[7-(pyridin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methanone is sourced from PubChem (CID 134072230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).