N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine

C10H10FN3O — CID 177136648

IUPACN-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine
SMILESC=N/C=C(/F)C1=C(C)OCn2ccnc21
InChIInChI=1S/C10H10FN3O/c1-7-9(8(11)5-12-2)10-13-3-4-14(10)6-15-7/h3-5H,2,6H2,1H3/b8-5+
InChIKeyOBCKHOQGTQTUGV-VMPITWQZSA-N
MW207.21 g/mol
LogP2.11
Rot. Bonds2

About N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine

N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine (PubChem CID 177136648) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine.

Molecular Properties

Compound NameN-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine
PubChem CID177136648
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC NameN-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine
SMILESC=N/C=C(/F)C1=C(C)OCn2ccnc21
InChIInChI=1S/C10H10FN3O/c1-7-9(8(11)5-12-2)10-13-3-4-14(10)6-15-7/h3-5H,2,6H2,1H3/b8-5+
InChIKeyOBCKHOQGTQTUGV-VMPITWQZSA-N
XLogP2.11
TPSA39.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine with MolForge

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Related Compounds

(Z)-N-[3-bromo-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazin-7-yl]ethanimine
CID 177136647
7-ethenyl-8-(1-fluoroethenyl)-5H-imidazo[1,2-c][1,3]oxazine
CID 177136746
8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine
CID 177136852
iridium;4-(1-methylimidazol-2-yl)-3H-pyridin-3-ide
CID 57816041
Iridium;2-(3-methoxybenzene-6-id-1-yl)-1-methylimidazole
CID 59348254
(2E,4E)-4-(1-methylimidazol-2-yl)hepta-2,4,6-trien-2-ol
CID 132148037
methyl N-[(1E)-3-(1-methylimidazol-2-yl)buta-1,3-dienyl]methanimidate
CID 137446470
(E)-3-(1-methylimidazol-2-yl)but-2-en-2-ol
CID 173882557
2-(2-Methoxybenzene-6-id-1-yl)-1-methylimidazol-1-ium-3-ide;yttrium
CID 176588755
N-[7-[(Z)-prop-1-enyl]-5H-imidazo[1,2-c][1,3]oxazin-8-yl]methanimine
CID 177136733
8-(1-fluoroethenyl)-7-methyl-5H-imidazo[1,2-c][1,3]oxazine;prop-1-ene
CID 177136851

Frequently Asked Questions

What is the IUPAC name of N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine?
The IUPAC name of N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine (CID 177136648) is N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine.
What is the SMILES notation for N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine?
The canonical SMILES for N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine is C=N/C=C(/F)C1=C(C)OCn2ccnc21.
What is the InChIKey of N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine?
The InChIKey is OBCKHOQGTQTUGV-VMPITWQZSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-7-9(8(11)5-12-2)10-13-3-4-14(10)6-15-7/h3-5H,2,6H2,1H3/b8-5+.
What are the key properties of N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine?
N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine has a molecular weight of 207.21 g/mol, XLogP of 2.11, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2-fluoro-2-(7-methyl-5H-imidazo[1,2-c][1,3]oxazin-8-yl)ethenyl]methanimine is sourced from PubChem (CID 177136648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).