(4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one

C8H7F2NO3 — CID 10867400

IUPAC(4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one
SMILESO=C1N[C@H](c2ccco2)[C@H](C(F)F)O1
InChIInChI=1S/C8H7F2NO3/c9-7(10)6-5(11-8(12)14-6)4-2-1-3-13-4/h1-3,5-7H,(H,11,12)/t5-,6-/m1/s1
InChIKeyFHHMIMBCRGJYEO-PHDIDXHHSA-N
MW203.14 g/mol
LogP1.69
Rot. Bonds2

About (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one

(4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one (PubChem CID 10867400) has the molecular formula C8H7F2NO3 and a molecular weight of 203.14 g/mol. Its IUPAC name is (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one
PubChem CID10867400
Molecular FormulaC8H7F2NO3
Molecular Weight203.14 g/mol
Exact Mass203.04
IUPAC Name(4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one
SMILESO=C1N[C@H](c2ccco2)[C@H](C(F)F)O1
InChIInChI=1S/C8H7F2NO3/c9-7(10)6-5(11-8(12)14-6)4-2-1-3-13-4/h1-3,5-7H,(H,11,12)/t5-,6-/m1/s1
InChIKeyFHHMIMBCRGJYEO-PHDIDXHHSA-N
XLogP1.69
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.14
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-4-(furan-2-yl)azetidin-2-one
CID 82417177
(3S,4S)-4-(furan-2-yl)-3-prop-1-en-2-ylazetidin-2-one
CID 131123234
5-(furan-2-yl)-2-oxoimidazolidine-4-carboxylic acid
CID 112710445
4-(difluoromethyl)-5-phenyl-1,3-oxazolidin-2-one
CID 84723470
(4S)-4-(cyclohexylmethyl)-5-(furan-2-yl)-1,3-oxazolidin-2-one
CID 70049261
(3S,4R)-3-amino-1-(4-fluorophenyl)-4-(furan-2-yl)azetidin-2-one
CID 124503350
(4R,5R)-4-(furan-2-yl)-6-oxo-2-sulfanylidene-1,3-diazinane-5-carbonitrile
CID 92529043
(2S,3R,5R,6S)-2,6-bis(furan-2-yl)-4,4-dimethyl-3,5-dinitropiperidine
CID 11905247
4-(furan-2-yl)-5-methylpyrrolidin-2-one
CID 66108911
2-(furan-2-yl)piperidin-3-amine
CID 82125093
2-(furan-2-yl)-3-methyl-1,2-dihydroquinazolin-4-one
CID 47117581
[3-(furan-2-yl)aziridin-2-yl]-phenylmethanone
CID 101449094

Frequently Asked Questions

What is the IUPAC name of (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one?
The IUPAC name of (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one (CID 10867400) is (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one?
The canonical SMILES for (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one is O=C1N[C@H](c2ccco2)[C@H](C(F)F)O1.
What is the InChIKey of (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one?
The InChIKey is FHHMIMBCRGJYEO-PHDIDXHHSA-N. The full InChI is InChI=1S/C8H7F2NO3/c9-7(10)6-5(11-8(12)14-6)4-2-1-3-13-4/h1-3,5-7H,(H,11,12)/t5-,6-/m1/s1.
What are the key properties of (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one?
(4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one has a molecular weight of 203.14 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5R)-5-(difluoromethyl)-4-(furan-2-yl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 10867400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).