(3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine

C15H13F2NO — CID 166109921

IUPAC(3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine
SMILESFc1cccc(-c2cc(F)cc([C@H]3CCON3)c2)c1
InChIInChI=1S/C15H13F2NO/c16-13-3-1-2-10(7-13)11-6-12(9-14(17)8-11)15-4-5-19-18-15/h1-3,6-9,15,18H,4-5H2/t15-/m1/s1
InChIKeyXKGIIDXJODNEGZ-OAHLLOKOSA-N
MW261.27 g/mol
LogP3.60
Rot. Bonds2

About (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine

(3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine (PubChem CID 166109921) has the molecular formula C15H13F2NO and a molecular weight of 261.27 g/mol. Its IUPAC name is (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine.

Molecular Properties

Compound Name(3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine
PubChem CID166109921
Molecular FormulaC15H13F2NO
Molecular Weight261.27 g/mol
Exact Mass261.10
IUPAC Name(3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine
SMILESFc1cccc(-c2cc(F)cc([C@H]3CCON3)c2)c1
InChIInChI=1S/C15H13F2NO/c16-13-3-1-2-10(7-13)11-6-12(9-14(17)8-11)15-4-5-19-18-15/h1-3,6-9,15,18H,4-5H2/t15-/m1/s1
InChIKeyXKGIIDXJODNEGZ-OAHLLOKOSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine
CID 166110291
(3R)-3-[3-[2-(3-fluorophenyl)ethynyl]phenyl]-1,2-oxazolidine
CID 166110101
(3R)-3-[4-chloro-3-[(3-fluorophenyl)methoxy]phenyl]-1,2-oxazolidine
CID 166110225
(4R)-4-(3-fluorophenyl)-1,3-oxazinan-2-one
CID 130642910
1-fluoro-3-(3-fluorophenyl)-5-methylbenzene
CID 46313952
2,6-bis(3-fluorophenyl)piperidin-4-one
CID 91540482
3-[4-(trifluoromethyl)phenyl]-1,2-oxazolidine
CID 105470618
1-(3-fluorophenyl)-3,5-diphenylbenzene
CID 141411457
4-(3-fluorophenyl)-5-pyrrolidin-2-yl-1,2-oxazole
CID 115038784
5-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2,4-oxadiazole
CID 91528540
4-(3-fluorophenyl)-1,2-oxazolidine
CID 105433367
1-fluoro-3-phenylbenzene;phosphane;hydrochloride
CID 175120364

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
The IUPAC name of (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine (CID 166109921) is (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine.
What is the SMILES notation for (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
The canonical SMILES for (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine is Fc1cccc(-c2cc(F)cc([C@H]3CCON3)c2)c1.
What is the InChIKey of (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
The InChIKey is XKGIIDXJODNEGZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H13F2NO/c16-13-3-1-2-10(7-13)11-6-12(9-14(17)8-11)15-4-5-19-18-15/h1-3,6-9,15,18H,4-5H2/t15-/m1/s1.
What are the key properties of (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
(3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine has a molecular weight of 261.27 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine is sourced from PubChem (CID 166109921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).