1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine

C17H17FN4OS — CID 154802281

IUPAC1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine
SMILESFc1ccccc1-c1csc(CNCc2cnc3n2CCOC3)n1
InChIInChI=1S/C17H17FN4OS/c18-14-4-2-1-3-13(14)15-11-24-17(21-15)9-19-7-12-8-20-16-10-23-6-5-22(12)16/h1-4,8,11,19H,5-7,9-10H2
InChIKeyGFHYXGGFEOSMPA-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.97
Rot. Bonds5

About 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine

1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine (PubChem CID 154802281) has the molecular formula C17H17FN4OS and a molecular weight of 344.42 g/mol. Its IUPAC name is 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine.

Molecular Properties

Compound Name1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine
PubChem CID154802281
Molecular FormulaC17H17FN4OS
Molecular Weight344.42 g/mol
Exact Mass344.11
IUPAC Name1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine
SMILESFc1ccccc1-c1csc(CNCc2cnc3n2CCOC3)n1
InChIInChI=1S/C17H17FN4OS/c18-14-4-2-1-3-13(14)15-11-24-17(21-15)9-19-7-12-8-20-16-10-23-6-5-22(12)16/h1-4,8,11,19H,5-7,9-10H2
InChIKeyGFHYXGGFEOSMPA-UHFFFAOYSA-N
XLogP2.97
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine?
The IUPAC name of 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine (CID 154802281) is 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine.
What is the SMILES notation for 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine?
The canonical SMILES for 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine is Fc1ccccc1-c1csc(CNCc2cnc3n2CCOC3)n1.
What is the InChIKey of 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine?
The InChIKey is GFHYXGGFEOSMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN4OS/c18-14-4-2-1-3-13(14)15-11-24-17(21-15)9-19-7-12-8-20-16-10-23-6-5-22(12)16/h1-4,8,11,19H,5-7,9-10H2.
What are the key properties of 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine?
1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine has a molecular weight of 344.42 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)-N-[[4-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]methanamine is sourced from PubChem (CID 154802281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).