3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine

C6H7FN2O — CID 154722197

IUPAC3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine
SMILESFc1cnn2c1COCC2
InChIInChI=1S/C6H7FN2O/c7-5-3-8-9-1-2-10-4-6(5)9/h3H,1-2,4H2
InChIKeyZFAIUBVYYSYWJM-UHFFFAOYSA-N
MW142.13 g/mol
LogP0.55
Rot. Bonds

About 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine

3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine (PubChem CID 154722197) has the molecular formula C6H7FN2O and a molecular weight of 142.13 g/mol. Its IUPAC name is 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine.

Molecular Properties

Compound Name3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine
PubChem CID154722197
Molecular FormulaC6H7FN2O
Molecular Weight142.13 g/mol
Exact Mass142.05
IUPAC Name3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine
SMILESFc1cnn2c1COCC2
InChIInChI=1S/C6H7FN2O/c7-5-3-8-9-1-2-10-4-6(5)9/h3H,1-2,4H2
InChIKeyZFAIUBVYYSYWJM-UHFFFAOYSA-N
XLogP0.55
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.13
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine?
The IUPAC name of 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine (CID 154722197) is 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine.
What is the SMILES notation for 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine?
The canonical SMILES for 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine is Fc1cnn2c1COCC2.
What is the InChIKey of 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine?
The InChIKey is ZFAIUBVYYSYWJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O/c7-5-3-8-9-1-2-10-4-6(5)9/h3H,1-2,4H2.
What are the key properties of 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine?
3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine has a molecular weight of 142.13 g/mol, XLogP of 0.55, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine is sourced from PubChem (CID 154722197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).