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

C15H17FN6O2 — CID 97390967

IUPAC[7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1cnc2n1CCN(c1ncc(F)cn1)C2)N1CCOCC1
InChIInChI=1S/C15H17FN6O2/c16-11-7-18-15(19-8-11)21-1-2-22-12(9-17-13(22)10-21)14(23)20-3-5-24-6-4-20/h7-9H,1-6,10H2
InChIKeyYWDQJWBOAKYBOX-UHFFFAOYSA-N
MW332.34 g/mol
LogP0.30
Rot. Bonds2

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

[7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone (PubChem CID 97390967) has the molecular formula C15H17FN6O2 and a molecular weight of 332.34 g/mol. Its IUPAC name is [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone
PubChem CID97390967
Molecular FormulaC15H17FN6O2
Molecular Weight332.34 g/mol
Exact Mass332.14
IUPAC Name[7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1cnc2n1CCN(c1ncc(F)cn1)C2)N1CCOCC1
InChIInChI=1S/C15H17FN6O2/c16-11-7-18-15(19-8-11)21-1-2-22-12(9-17-13(22)10-21)14(23)20-3-5-24-6-4-20/h7-9H,1-6,10H2
InChIKeyYWDQJWBOAKYBOX-UHFFFAOYSA-N
XLogP0.30
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.34
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1,3-dimethyl-8-morpholino-7-(2-(pyrimidin-2-ylthio)ethyl)-1H-purine-2,6(3H,7H)-dione
CID 1391881
4-{6-[4-(4-methylpiperidine-1-carbonyl)-1H-imidazol-1-yl]pyrimidin-4-yl}morpholine
CID 49667431
(1-(6-morpholinopyrimidin-4-yl)-1H-imidazol-4-yl)(thiomorpholino)methanone
CID 49667432
morpholino(1-(6-thiomorpholinopyrimidin-4-yl)-1H-imidazol-4-yl)methanone
CID 49667445
[3-[(4-methylpiperazin-1-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone
CID 97392163
7-[2-Hydroxy-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-1,3-dimethylpurine-2,6-dione
CID 2818412
(4-cyclohexylpiperazin-1-yl)-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-2-yl)methanone
CID 53167808
6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-2-yl(piperidin-1-yl)methanone
CID 53167816
1-[2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
CID 134789291
methyl 2-(morpholine-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate
CID 134791087
[2-(dimethylamino)pyrimidin-5-yl]-[2-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 46960208
4-{6-[4-(Morpholine-4-carbonyl)-1H-imidazol-1-YL]pyrimidin-4-YL}morpholine
CID 53172089

Frequently Asked Questions

What is the IUPAC name of [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone (CID 97390967) is [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone is O=C(c1cnc2n1CCN(c1ncc(F)cn1)C2)N1CCOCC1.
What is the InChIKey of [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is YWDQJWBOAKYBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN6O2/c16-11-7-18-15(19-8-11)21-1-2-22-12(9-17-13(22)10-21)14(23)20-3-5-24-6-4-20/h7-9H,1-6,10H2.
What are the key properties of [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone?
[7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 332.34 g/mol, XLogP of 0.30, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 97390967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).