8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine

C9H9FN2O — CID 177136852

IUPAC8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine
SMILESC=C(F)C1=C(C)OCn2ccnc21
InChIInChI=1S/C9H9FN2O/c1-6(10)8-7(2)13-5-12-4-3-11-9(8)12/h3-4H,1,5H2,2H3
InChIKeyCFQBCKYGDVWKHE-UHFFFAOYSA-N
MW180.18 g/mol
LogP2.09
Rot. Bonds1

About 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine

8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine (PubChem CID 177136852) has the molecular formula C9H9FN2O and a molecular weight of 180.18 g/mol. Its IUPAC name is 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine.

Molecular Properties

Compound Name8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine
PubChem CID177136852
Molecular FormulaC9H9FN2O
Molecular Weight180.18 g/mol
Exact Mass180.07
IUPAC Name8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine
SMILESC=C(F)C1=C(C)OCn2ccnc21
InChIInChI=1S/C9H9FN2O/c1-6(10)8-7(2)13-5-12-4-3-11-9(8)12/h3-4H,1,5H2,2H3
InChIKeyCFQBCKYGDVWKHE-UHFFFAOYSA-N
XLogP2.09
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.18
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine?
The IUPAC name of 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine (CID 177136852) is 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine.
What is the SMILES notation for 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine?
The canonical SMILES for 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine is C=C(F)C1=C(C)OCn2ccnc21.
What is the InChIKey of 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine?
The InChIKey is CFQBCKYGDVWKHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2O/c1-6(10)8-7(2)13-5-12-4-3-11-9(8)12/h3-4H,1,5H2,2H3.
What are the key properties of 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine?
8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine has a molecular weight of 180.18 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine is sourced from PubChem (CID 177136852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).