2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine

C6H6FN3O — CID 169118432

IUPAC2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine
SMILESCc1cnc2c(n1)NC(F)O2
InChIInChI=1S/C6H6FN3O/c1-3-2-8-5-4(9-3)10-6(7)11-5/h2,6H,1H3,(H,9,10)
InChIKeyUNMNSCWGRSEOBO-UHFFFAOYSA-N
MW155.13 g/mol
LogP0.84
Rot. Bonds

About 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine

2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine (PubChem CID 169118432) has the molecular formula C6H6FN3O and a molecular weight of 155.13 g/mol. Its IUPAC name is 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine.

Molecular Properties

Compound Name2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine
PubChem CID169118432
Molecular FormulaC6H6FN3O
Molecular Weight155.13 g/mol
Exact Mass155.05
IUPAC Name2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine
SMILESCc1cnc2c(n1)NC(F)O2
InChIInChI=1S/C6H6FN3O/c1-3-2-8-5-4(9-3)10-6(7)11-5/h2,6H,1H3,(H,9,10)
InChIKeyUNMNSCWGRSEOBO-UHFFFAOYSA-N
XLogP0.84
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.13
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

3-Methoxy-5-methyl-2-pyrazinamine
CID 10701894
6-(fluoromethoxy)-N,3-dimethylpyrazin-2-amine
CID 89976641
N-cyclopropyl-6-(fluoromethoxy)-3-methylpyrazin-2-amine
CID 89976646
6-(Fluoromethoxy)-3-methylpyrazin-2-amine
CID 89976694
3-Methoxy-5-(trifluoromethyl)pyrazin-2-amine
CID 130116244
2-Fluoro-5-propan-2-yl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine
CID 169118930
3-(Difluoromethoxy)-6-methylpyrazin-2-amine
CID 170384835
5-(Difluoromethyl)-3-methoxypyrazin-2-amine
CID 172362406
3-Methoxy-6-methylpyrazin-2-amine
CID 54384494
3-methoxy-N,5-dimethylpyrazin-2-amine
CID 59693813
N-(3-methoxy-5-methylpyrazin-2-yl)formamide
CID 91597078
5-methyl-3H-[1,3]oxazolo[4,5-b]pyrazin-2-one
CID 130251237

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine?
The IUPAC name of 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine (CID 169118432) is 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine.
What is the SMILES notation for 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine?
The canonical SMILES for 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine is Cc1cnc2c(n1)NC(F)O2.
What is the InChIKey of 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine?
The InChIKey is UNMNSCWGRSEOBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6FN3O/c1-3-2-8-5-4(9-3)10-6(7)11-5/h2,6H,1H3,(H,9,10).
What are the key properties of 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine?
2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine has a molecular weight of 155.13 g/mol, XLogP of 0.84, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methyl-2,3-dihydro-[1,3]oxazolo[4,5-b]pyrazine is sourced from PubChem (CID 169118432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).