oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone

C15H18N6O2 — CID 133140974

IUPACoxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone
SMILESO=C(C1CN(c2ncccn2)Cc2cncn21)N1CCCCO1
InChIInChI=1S/C15H18N6O2/c22-14(21-6-1-2-7-23-21)13-10-19(15-17-4-3-5-18-15)9-12-8-16-11-20(12)13/h3-5,8,11,13H,1-2,6-7,9-10H2
InChIKeyJNRLCZAORKZRQN-UHFFFAOYSA-N
MW314.35 g/mol
LogP0.79
Rot. Bonds2

About oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone

oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone (PubChem CID 133140974) has the molecular formula C15H18N6O2 and a molecular weight of 314.35 g/mol. Its IUPAC name is oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone.

Molecular Properties

Compound Nameoxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone
PubChem CID133140974
Molecular FormulaC15H18N6O2
Molecular Weight314.35 g/mol
Exact Mass314.15
IUPAC Nameoxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone
SMILESO=C(C1CN(c2ncccn2)Cc2cncn21)N1CCCCO1
InChIInChI=1S/C15H18N6O2/c22-14(21-6-1-2-7-23-21)13-10-19(15-17-4-3-5-18-15)9-12-8-16-11-20(12)13/h3-5,8,11,13H,1-2,6-7,9-10H2
InChIKeyJNRLCZAORKZRQN-UHFFFAOYSA-N
XLogP0.79
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1,2-oxazolidin-2-yl-[7-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl]methanone
CID 131641510
[7-(3-methyl-1-benzofuran-2-carbonyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl]-(1,2-oxazolidin-2-yl)methanone
CID 131693821
1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone
CID 131693815
[(3R,3aS,6aS)-5-pyrimidin-2-yl-2,3,3a,4,6,6a-hexahydrofuro[2,3-c]pyrrol-3-yl]-(oxazinan-2-yl)methanone
CID 97483859
[(7S)-8-methyl-2-pyrimidin-2-yl-5-oxa-2,8-diazaspiro[3.5]nonan-7-yl]-(1,2-oxazolidin-2-yl)methanone
CID 124809338
(5R)-N-(cyclopropylmethyl)-7-(5-fluoropyrimidin-2-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 124782068
[(3aS,5S,7aS)-1-pyrimidin-2-yl-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-5-yl]-(oxazinan-2-yl)methanone
CID 124787082
[(4R,4aS,8aR)-6-pyrimidin-2-yl-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyridin-4-yl]-(1,2-oxazolidin-2-yl)methanone;2,2,2-trifluoroacetic acid
CID 155832737
5-(pyridin-3-ylmethoxymethyl)-7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 131639467
2-[[(7S)-5-pyrimidin-2-yl-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepin-7-yl]oxy]-1-pyrrolidin-1-ylethanone
CID 124785823
1,2-oxazolidin-2-yl-[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methanone;2,2,2-trifluoroacetic acid
CID 155844996
2-[(3aS,6aR)-5-pyrimidin-2-yl-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-3a-yl]-1-(oxazinan-2-yl)ethanone;2,2,2-trifluoroacetic acid
CID 155833234

Frequently Asked Questions

What is the IUPAC name of oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
The IUPAC name of oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone (CID 133140974) is oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone.
What is the SMILES notation for oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
The canonical SMILES for oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone is O=C(C1CN(c2ncccn2)Cc2cncn21)N1CCCCO1.
What is the InChIKey of oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
The InChIKey is JNRLCZAORKZRQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O2/c22-14(21-6-1-2-7-23-21)13-10-19(15-17-4-3-5-18-15)9-12-8-16-11-20(12)13/h3-5,8,11,13H,1-2,6-7,9-10H2.
What are the key properties of oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone has a molecular weight of 314.35 g/mol, XLogP of 0.79, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for oxazinan-2-yl-(7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone is sourced from PubChem (CID 133140974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).