2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone

C13H20N4O2 — CID 124802829

IUPAC2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone
SMILESC[C@@H]1NCCn2cc(CC(=O)N3CCOCC3)nc21
InChIInChI=1S/C13H20N4O2/c1-10-13-15-11(9-17(13)3-2-14-10)8-12(18)16-4-6-19-7-5-16/h9-10,14H,2-8H2,1H3/t10-/m0/s1
InChIKeyNRKZHOXRRBPTFJ-JTQLQIEISA-N
MW264.33 g/mol
LogP-0.05
Rot. Bonds2

About 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone

2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone (PubChem CID 124802829) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone
PubChem CID124802829
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone
SMILESC[C@@H]1NCCn2cc(CC(=O)N3CCOCC3)nc21
InChIInChI=1S/C13H20N4O2/c1-10-13-15-11(9-17(13)3-2-14-10)8-12(18)16-4-6-19-7-5-16/h9-10,14H,2-8H2,1H3/t10-/m0/s1
InChIKeyNRKZHOXRRBPTFJ-JTQLQIEISA-N
XLogP-0.05
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone (CID 124802829) is 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone is C[C@@H]1NCCn2cc(CC(=O)N3CCOCC3)nc21.
What is the InChIKey of 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
The InChIKey is NRKZHOXRRBPTFJ-JTQLQIEISA-N. The full InChI is InChI=1S/C13H20N4O2/c1-10-13-15-11(9-17(13)3-2-14-10)8-12(18)16-4-6-19-7-5-16/h9-10,14H,2-8H2,1H3/t10-/m0/s1.
What are the key properties of 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone?
2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone has a molecular weight of 264.33 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 124802829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).