(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

C21H17FN4O2 — CID 125126094

IUPAC(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
SMILESCc1ccccc1-c1noc(-c2ncn3c2CO[C@H](c2ccc(F)cc2)C3)n1
InChIInChI=1S/C21H17FN4O2/c1-13-4-2-3-5-16(13)20-24-21(28-25-20)19-17-11-27-18(10-26(17)12-23-19)14-6-8-15(22)9-7-14/h2-9,12,18H,10-11H2,1H3/t18-/m0/s1
InChIKeyCREVVEMCPBOADL-SFHVURJKSA-N
MW376.39 g/mol
LogP4.32
Rot. Bonds3

About (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

(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 (PubChem CID 125126094) has the molecular formula C21H17FN4O2 and a molecular weight of 376.39 g/mol. Its IUPAC name is (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.

Molecular Properties

Compound Name(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
PubChem CID125126094
Molecular FormulaC21H17FN4O2
Molecular Weight376.39 g/mol
Exact Mass376.13
IUPAC Name(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
SMILESCc1ccccc1-c1noc(-c2ncn3c2CO[C@H](c2ccc(F)cc2)C3)n1
InChIInChI=1S/C21H17FN4O2/c1-13-4-2-3-5-16(13)20-24-21(28-25-20)19-17-11-27-18(10-26(17)12-23-19)14-6-8-15(22)9-7-14/h2-9,12,18H,10-11H2,1H3/t18-/m0/s1
InChIKeyCREVVEMCPBOADL-SFHVURJKSA-N
XLogP4.32
TPSA65.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.39
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (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 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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)-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
(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
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
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
(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-fluorophenyl)-1-[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 91894198
(6R)-1-[3-(3-fluoro-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-6-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine
CID 125127832
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
(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

Frequently Asked Questions

What is the IUPAC name of (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?
The IUPAC name of (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) is (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.
What is the SMILES notation for (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?
The canonical SMILES for (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 is Cc1ccccc1-c1noc(-c2ncn3c2CO[C@H](c2ccc(F)cc2)C3)n1.
What is the InChIKey of (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?
The InChIKey is CREVVEMCPBOADL-SFHVURJKSA-N. The full InChI is InChI=1S/C21H17FN4O2/c1-13-4-2-3-5-16(13)20-24-21(28-25-20)19-17-11-27-18(10-26(17)12-23-19)14-6-8-15(22)9-7-14/h2-9,12,18H,10-11H2,1H3/t18-/m0/s1.
What are the key properties of (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?
(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 has a molecular weight of 376.39 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (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 is sourced from PubChem (CID 125126094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).