methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate

C13H18N4O4 — CID 134791087

IUPACmethyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate
SMILESCOC(=O)N1CCn2cc(C(=O)N3CCOCC3)nc2C1
InChIInChI=1S/C13H18N4O4/c1-20-13(19)17-3-2-16-8-10(14-11(16)9-17)12(18)15-4-6-21-7-5-15/h8H,2-7,9H2,1H3
InChIKeyQLMFTUZRGVKWHU-UHFFFAOYSA-N
MW294.31 g/mol
LogP-0.06
Rot. Bonds1

About methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate

methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate (PubChem CID 134791087) has the molecular formula C13H18N4O4 and a molecular weight of 294.31 g/mol. Its IUPAC name is methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate.

Molecular Properties

Compound Namemethyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate
PubChem CID134791087
Molecular FormulaC13H18N4O4
Molecular Weight294.31 g/mol
Exact Mass294.13
IUPAC Namemethyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate
SMILESCOC(=O)N1CCn2cc(C(=O)N3CCOCC3)nc2C1
InChIInChI=1S/C13H18N4O4/c1-20-13(19)17-3-2-16-8-10(14-11(16)9-17)12(18)15-4-6-21-7-5-15/h8H,2-7,9H2,1H3
InChIKeyQLMFTUZRGVKWHU-UHFFFAOYSA-N
XLogP-0.06
TPSA76.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate?
The IUPAC name of methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate (CID 134791087) is methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate.
What is the SMILES notation for methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate?
The canonical SMILES for methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate is COC(=O)N1CCn2cc(C(=O)N3CCOCC3)nc2C1.
What is the InChIKey of methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate?
The InChIKey is QLMFTUZRGVKWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O4/c1-20-13(19)17-3-2-16-8-10(14-11(16)9-17)12(18)15-4-6-21-7-5-15/h8H,2-7,9H2,1H3.
What are the key properties of methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate?
methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate has a molecular weight of 294.31 g/mol, XLogP of -0.06, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate is sourced from PubChem (CID 134791087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).