(4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one

C20H15FN2O2 — CID 69281905

IUPAC(4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one
SMILESO=C1N[C@@H](c2cccc(-c3ccccc3)n2)[C@H](c2ccc(F)cc2)O1
InChIInChI=1S/C20H15FN2O2/c21-15-11-9-14(10-12-15)19-18(23-20(24)25-19)17-8-4-7-16(22-17)13-5-2-1-3-6-13/h1-12,18-19H,(H,23,24)/t18-,19-/m0/s1
InChIKeyXHXHTWXRSGIWQV-OALUTQOASA-N
MW334.35 g/mol
LogP4.41
Rot. Bonds3

About (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one

(4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one (PubChem CID 69281905) has the molecular formula C20H15FN2O2 and a molecular weight of 334.35 g/mol. Its IUPAC name is (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one
PubChem CID69281905
Molecular FormulaC20H15FN2O2
Molecular Weight334.35 g/mol
Exact Mass334.11
IUPAC Name(4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one
SMILESO=C1N[C@@H](c2cccc(-c3ccccc3)n2)[C@H](c2ccc(F)cc2)O1
InChIInChI=1S/C20H15FN2O2/c21-15-11-9-14(10-12-15)19-18(23-20(24)25-19)17-8-4-7-16(22-17)13-5-2-1-3-6-13/h1-12,18-19H,(H,23,24)/t18-,19-/m0/s1
InChIKeyXHXHTWXRSGIWQV-OALUTQOASA-N
XLogP4.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.35
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one?
The IUPAC name of (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one (CID 69281905) is (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one is O=C1N[C@@H](c2cccc(-c3ccccc3)n2)[C@H](c2ccc(F)cc2)O1.
What is the InChIKey of (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one?
The InChIKey is XHXHTWXRSGIWQV-OALUTQOASA-N. The full InChI is InChI=1S/C20H15FN2O2/c21-15-11-9-14(10-12-15)19-18(23-20(24)25-19)17-8-4-7-16(22-17)13-5-2-1-3-6-13/h1-12,18-19H,(H,23,24)/t18-,19-/m0/s1.
What are the key properties of (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one?
(4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one has a molecular weight of 334.35 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5S)-5-(4-fluorophenyl)-4-(6-phenyl-2-pyridinyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 69281905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).