(Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine

C10H9BrFN3O — CID 177136647

IUPAC(Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine
SMILESC=C(F)C1=C(/N=C\C)OCn2c(Br)cnc21
InChIInChI=1S/C10H9BrFN3O/c1-3-13-10-8(6(2)12)9-14-4-7(11)15(9)5-16-10/h3-4H,2,5H2,1H3/b13-3-
InChIKeyOUEXLBZZHGUQGK-DXNYSGJVSA-N
MW286.10 g/mol
LogP2.88
Rot. Bonds2

About (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine

(Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine (PubChem CID 177136647) has the molecular formula C10H9BrFN3O and a molecular weight of 286.10 g/mol. Its IUPAC name is (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine.

Molecular Properties

Compound Name(Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine
PubChem CID177136647
Molecular FormulaC10H9BrFN3O
Molecular Weight286.10 g/mol
Exact Mass284.99
IUPAC Name(Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine
SMILESC=C(F)C1=C(/N=C\C)OCn2c(Br)cnc21
InChIInChI=1S/C10H9BrFN3O/c1-3-13-10-8(6(2)12)9-14-4-7(11)15(9)5-16-10/h3-4H,2,5H2,1H3/b13-3-
InChIKeyOUEXLBZZHGUQGK-DXNYSGJVSA-N
XLogP2.88
TPSA39.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.10
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine with MolForge

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Related Compounds

N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine
CID 177136648
7-ethenyl-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazine
CID 177136746
2-bromo-7-fluoro-5H-imidazo[2,1-b][1,3]oxazine
CID 91755277
2-bromo-6-fluoro-5H-imidazo[2,1-b][1,3]oxazine
CID 122174114
8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine
CID 177136852
methyl N-[(1E)-3-(1-methylimidazol-2-yl)buta-1,3-dienyl]methanimidate
CID 137446470
5-Bromo-1-(3-methylbuta-1,3-dien-2-yl)-2-prop-1-en-2-ylimidazole
CID 170968376
8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine;prop-1-ene
CID 177136851
2-(5-bromo-1-methylimidazol-2-yl)-N-methylprop-2-en-1-imine
CID 177136680

Frequently Asked Questions

What is the IUPAC name of (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine?
The IUPAC name of (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine (CID 177136647) is (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine.
What is the SMILES notation for (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine?
The canonical SMILES for (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine is C=C(F)C1=C(/N=C\C)OCn2c(Br)cnc21.
What is the InChIKey of (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine?
The InChIKey is OUEXLBZZHGUQGK-DXNYSGJVSA-N. The full InChI is InChI=1S/C10H9BrFN3O/c1-3-13-10-8(6(2)12)9-14-4-7(11)15(9)5-16-10/h3-4H,2,5H2,1H3/b13-3-.
What are the key properties of (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine?
(Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine has a molecular weight of 286.10 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine is sourced from PubChem (CID 177136647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).