(6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine

C20H15FN4O2 — CID 125128134

IUPAC(6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
SMILESFc1ccccc1-c1noc(-c2ncn3c2CO[C@H](c2ccccc2)C3)n1
InChIInChI=1S/C20H15FN4O2/c21-15-9-5-4-8-14(15)19-23-20(27-24-19)18-16-11-26-17(10-25(16)12-22-18)13-6-2-1-3-7-13/h1-9,12,17H,10-11H2/t17-/m0/s1
InChIKeyRYDWVVLPKDMBCP-KRWDZBQOSA-N
MW362.36 g/mol
LogP4.01
Rot. Bonds3

About (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine

(6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine (PubChem CID 125128134) has the molecular formula C20H15FN4O2 and a molecular weight of 362.36 g/mol. Its IUPAC name is (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine.

Molecular Properties

Compound Name(6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
PubChem CID125128134
Molecular FormulaC20H15FN4O2
Molecular Weight362.36 g/mol
Exact Mass362.12
IUPAC Name(6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
SMILESFc1ccccc1-c1noc(-c2ncn3c2CO[C@H](c2ccccc2)C3)n1
InChIInChI=1S/C20H15FN4O2/c21-15-9-5-4-8-14(15)19-23-20(27-24-19)18-16-11-26-17(10-25(16)12-22-18)13-6-2-1-3-7-13/h1-9,12,17H,10-11H2/t17-/m0/s1
InChIKeyRYDWVVLPKDMBCP-KRWDZBQOSA-N
XLogP4.01
TPSA65.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.36
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine with MolForge

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Related Compounds

6-(4-fluorophenyl)-1-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 91894185
(6R)-6-(4-fluorophenyl)-1-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125126094
(6R)-1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-6-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125128690
(6S)-6-(4-fluorophenyl)-1-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125126090
(6S)-1-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125127329
(6R)-6-phenyl-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125126731
1-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]-6-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 91894231
1-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]-6-(3-fluorophenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 91894259
1-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-6-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 91894201
(6R)-1-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-6-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125127693
(6S)-1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-6-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125126016
6-(4-methoxyphenyl)-1-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 91894235

Frequently Asked Questions

What is the IUPAC name of (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine?
The IUPAC name of (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine (CID 125128134) is (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine.
What is the SMILES notation for (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine?
The canonical SMILES for (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine is Fc1ccccc1-c1noc(-c2ncn3c2CO[C@H](c2ccccc2)C3)n1.
What is the InChIKey of (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine?
The InChIKey is RYDWVVLPKDMBCP-KRWDZBQOSA-N. The full InChI is InChI=1S/C20H15FN4O2/c21-15-9-5-4-8-14(15)19-23-20(27-24-19)18-16-11-26-17(10-25(16)12-22-18)13-6-2-1-3-7-13/h1-9,12,17H,10-11H2/t17-/m0/s1.
What are the key properties of (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine?
(6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine has a molecular weight of 362.36 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-1-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-phenyl-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine is sourced from PubChem (CID 125128134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).