3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine

C7H9FN2O — CID 145046782

IUPAC3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
SMILESCN1CCc2c(F)noc2C1
InChIInChI=1S/C7H9FN2O/c1-10-3-2-5-6(4-10)11-9-7(5)8/h2-4H2,1H3
InChIKeyOMKCGNAYFCPMBX-UHFFFAOYSA-N
MW156.16 g/mol
LogP0.80
Rot. Bonds

About 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine

3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine (PubChem CID 145046782) has the molecular formula C7H9FN2O and a molecular weight of 156.16 g/mol. Its IUPAC name is 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine.

Molecular Properties

Compound Name3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
PubChem CID145046782
Molecular FormulaC7H9FN2O
Molecular Weight156.16 g/mol
Exact Mass156.07
IUPAC Name3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine
SMILESCN1CCc2c(F)noc2C1
InChIInChI=1S/C7H9FN2O/c1-10-3-2-5-6(4-10)11-9-7(5)8/h2-4H2,1H3
InChIKeyOMKCGNAYFCPMBX-UHFFFAOYSA-N
XLogP0.80
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
The IUPAC name of 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine (CID 145046782) is 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine.
What is the SMILES notation for 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
The canonical SMILES for 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine is CN1CCc2c(F)noc2C1.
What is the InChIKey of 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
The InChIKey is OMKCGNAYFCPMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2O/c1-10-3-2-5-6(4-10)11-9-7(5)8/h2-4H2,1H3.
What are the key properties of 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine?
3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine has a molecular weight of 156.16 g/mol, XLogP of 0.80, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-methyl-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridine is sourced from PubChem (CID 145046782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).