(4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide

C16H13F2N3O4 — CID 95223374

IUPAC(4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide
SMILESO=C1N[C@@H](C(=O)NCc2cccnc2Oc2ccc(F)cc2F)CO1
InChIInChI=1S/C16H13F2N3O4/c17-10-3-4-13(11(18)6-10)25-15-9(2-1-5-19-15)7-20-14(22)12-8-24-16(23)21-12/h1-6,12H,7-8H2,(H,20,22)(H,21,23)/t12-/m1/s1
InChIKeyOPHULBZRDIZCBK-GFCCVEGCSA-N
MW349.29 g/mol
LogP1.88
Rot. Bonds5

About (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide

(4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide (PubChem CID 95223374) has the molecular formula C16H13F2N3O4 and a molecular weight of 349.29 g/mol. Its IUPAC name is (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide
PubChem CID95223374
Molecular FormulaC16H13F2N3O4
Molecular Weight349.29 g/mol
Exact Mass349.09
IUPAC Name(4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide
SMILESO=C1N[C@@H](C(=O)NCc2cccnc2Oc2ccc(F)cc2F)CO1
InChIInChI=1S/C16H13F2N3O4/c17-10-3-4-13(11(18)6-10)25-15-9(2-1-5-19-15)7-20-14(22)12-8-24-16(23)21-12/h1-6,12H,7-8H2,(H,20,22)(H,21,23)/t12-/m1/s1
InChIKeyOPHULBZRDIZCBK-GFCCVEGCSA-N
XLogP1.88
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.29
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide with MolForge

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Related Compounds

N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]pyrrolidine-3-carboxamide
CID 56757836
(4R)-N-[(2-butoxy-3-pyridinyl)methyl]-2-oxo-1,3-oxazolidine-4-carboxamide
CID 126840794
N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-hydroxyacetamide
CID 56751588
(3R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-1-ethylpyrrolidine-3-carboxamide
CID 95200429
(3S)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-1-ethylpyrrolidine-3-carboxamide
CID 95200428
N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-hydroxypropanamide
CID 56738262
(2R)-2-amino-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]propanamide
CID 56759225
(2S)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-hydroxy-3-methylbutanamide
CID 95219679
(3R)-N-[[2-(2-fluorophenoxy)-3-pyridinyl]methyl]-6,6-dimethyl-5-oxothiomorpholine-3-carboxamide
CID 95193249
N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-methyl-2-(methylamino)propanamide
CID 56759707
(3R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-3-methylpentanamide
CID 95190027
N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 42196758

Frequently Asked Questions

What is the IUPAC name of (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
The IUPAC name of (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide (CID 95223374) is (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide.
What is the SMILES notation for (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
The canonical SMILES for (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide is O=C1N[C@@H](C(=O)NCc2cccnc2Oc2ccc(F)cc2F)CO1.
What is the InChIKey of (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
The InChIKey is OPHULBZRDIZCBK-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H13F2N3O4/c17-10-3-4-13(11(18)6-10)25-15-9(2-1-5-19-15)7-20-14(22)12-8-24-16(23)21-12/h1-6,12H,7-8H2,(H,20,22)(H,21,23)/t12-/m1/s1.
What are the key properties of (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide?
(4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide has a molecular weight of 349.29 g/mol, XLogP of 1.88, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-N-[[2-(2,4-difluorophenoxy)-3-pyridinyl]methyl]-2-oxo-1,3-oxazolidine-4-carboxamide is sourced from PubChem (CID 95223374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).