(8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one

C6H10N2O2 — CID 66870718

IUPAC(8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one
SMILESO=C1OCN2CCNC[C@H]12
InChIInChI=1S/C6H10N2O2/c9-6-5-3-7-1-2-8(5)4-10-6/h5,7H,1-4H2/t5-/m1/s1
InChIKeyXREQBVWWORDFNS-RXMQYKEDSA-N
MW142.16 g/mol
LogP-1.23
Rot. Bonds

About (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one

(8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one (PubChem CID 66870718) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one.

Molecular Properties

Compound Name(8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one
PubChem CID66870718
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name(8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one
SMILESO=C1OCN2CCNC[C@H]12
InChIInChI=1S/C6H10N2O2/c9-6-5-3-7-1-2-8(5)4-10-6/h5,7H,1-4H2/t5-/m1/s1
InChIKeyXREQBVWWORDFNS-RXMQYKEDSA-N
XLogP-1.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Methyl 4-methylpiperazine-2-carboxylate
CID 12225060
3,8-Dioxohexahydro-3h-oxazolo[3,4-a]pyrazine
CID 169488832
Ethyl octahydropyrrolo[1,2-a]pyrazine-3-carboxylate
CID 13175076
Methyl 1-methylpiperazine-2-carboxylate
CID 18404484
6,7,8,8a-tetrahydro-5H-[1,3]oxazolo[3,4-a]pyrazine-1,3-dione
CID 18722348
methyl (2S)-1-methylpiperazine-2-carboxylate
CID 29920832
methyl (2R)-1-methylpiperazine-2-carboxylate
CID 29920834
(S)-methyl-4-methylpiperazine-2-carboxylate
CID 44141012
Methyl (R)-4-methylpiperazine-2-carboxylate
CID 44141014
(8aR)-6,7,8,8a-tetrahydro-5H-[1,3]oxazolo[3,4-a]pyrazine-1,3-dione
CID 59080518
Tert-butyl 1-oxo-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazine-5-carboxylate
CID 66797112
2-Pyrrolidin-1-ylethyl piperazine-2-carboxylate
CID 67014330

Frequently Asked Questions

What is the IUPAC name of (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one?
The IUPAC name of (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one (CID 66870718) is (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one.
What is the SMILES notation for (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one?
The canonical SMILES for (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one is O=C1OCN2CCNC[C@H]12.
What is the InChIKey of (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one?
The InChIKey is XREQBVWWORDFNS-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H10N2O2/c9-6-5-3-7-1-2-8(5)4-10-6/h5,7H,1-4H2/t5-/m1/s1.
What are the key properties of (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one?
(8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one has a molecular weight of 142.16 g/mol, XLogP of -1.23, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8aR)-3,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-1-one is sourced from PubChem (CID 66870718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).