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

C15H13F2NO — CID 166110291

IUPAC(3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine
SMILESFc1cccc(-c2cccc([C@H]3CCON3)c2F)c1
InChIInChI=1S/C15H13F2NO/c16-11-4-1-3-10(9-11)12-5-2-6-13(15(12)17)14-7-8-19-18-14/h1-6,9,14,18H,7-8H2/t14-/m1/s1
InChIKeyDPXCXLHHTKVGBT-CQSZACIVSA-N
MW261.27 g/mol
LogP3.60
Rot. Bonds2

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

(3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine (PubChem CID 166110291) has the molecular formula C15H13F2NO and a molecular weight of 261.27 g/mol. Its IUPAC name is (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine.

Molecular Properties

Compound Name(3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine
PubChem CID166110291
Molecular FormulaC15H13F2NO
Molecular Weight261.27 g/mol
Exact Mass261.10
IUPAC Name(3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine
SMILESFc1cccc(-c2cccc([C@H]3CCON3)c2F)c1
InChIInChI=1S/C15H13F2NO/c16-11-4-1-3-10(9-11)12-5-2-6-13(15(12)17)14-7-8-19-18-14/h1-6,9,14,18H,7-8H2/t14-/m1/s1
InChIKeyDPXCXLHHTKVGBT-CQSZACIVSA-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-[3-fluoro-5-(3-fluorophenyl)phenyl]-1,2-oxazolidine
CID 166109921
(3R)-3-[3-[2-(3-fluorophenyl)ethynyl]phenyl]-1,2-oxazolidine
CID 166110101
2-fluoro-1-(3-fluorophenyl)-3-methylbenzene
CID 46313946
4-(3-fluorophenyl)-5-pyrrolidin-2-yl-1,2-oxazole
CID 115038784
(3R)-3-[4-chloro-3-[(3-fluorophenyl)methoxy]phenyl]-1,2-oxazolidine
CID 166110225
1-fluoro-3-[2-(trifluoromethoxy)phenyl]benzene
CID 46313769
1-fluoro-3-(2-phenoxyphenyl)benzene
CID 56979029
1-fluoro-3-[3-(2-methoxyphenyl)phenyl]benzene
CID 175734991
9-(3-fluorophenyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
CID 68580169
1-fluoro-5-(3-fluorophenyl)naphthalene
CID 46313965
2-fluoro-3-(3-fluorophenyl)benzoyl chloride
CID 46312371
1-ethoxy-2,3-difluoro-4-(3-fluorophenyl)benzene
CID 22008080

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
The IUPAC name of (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine (CID 166110291) is (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine.
What is the SMILES notation for (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
The canonical SMILES for (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine is Fc1cccc(-c2cccc([C@H]3CCON3)c2F)c1.
What is the InChIKey of (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
The InChIKey is DPXCXLHHTKVGBT-CQSZACIVSA-N. The full InChI is InChI=1S/C15H13F2NO/c16-11-4-1-3-10(9-11)12-5-2-6-13(15(12)17)14-7-8-19-18-14/h1-6,9,14,18H,7-8H2/t14-/m1/s1.
What are the key properties of (3R)-3-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine?
(3R)-3-[2-fluoro-3-(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-[2-fluoro-3-(3-fluorophenyl)phenyl]-1,2-oxazolidine is sourced from PubChem (CID 166110291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).