(5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one

C10H10ClNO2 — CID 11310370

IUPAC(5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one
SMILESO=C1O[C@@H](CCl)CN1c1ccccc1
InChIInChI=1S/C10H10ClNO2/c11-6-9-7-12(10(13)14-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2/t9-/m0/s1
InChIKeyKARLWXPEKSFFJC-VIFPVBQESA-N
MW211.65 g/mol
LogP2.25
Rot. Bonds2

About (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one

(5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one (PubChem CID 11310370) has the molecular formula C10H10ClNO2 and a molecular weight of 211.65 g/mol. Its IUPAC name is (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one
PubChem CID11310370
Molecular FormulaC10H10ClNO2
Molecular Weight211.65 g/mol
Exact Mass211.04
IUPAC Name(5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one
SMILESO=C1O[C@@H](CCl)CN1c1ccccc1
InChIInChI=1S/C10H10ClNO2/c11-6-9-7-12(10(13)14-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2/t9-/m0/s1
InChIKeyKARLWXPEKSFFJC-VIFPVBQESA-N
XLogP2.25
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

5-(fluoromethyl)-3-phenyl-1,3-oxazolidin-2-one
CID 555364
5-benzyl-3-phenyl-1,3-oxazolidin-2-one
CID 21393580
5-(2-aminoethyl)-3-phenyl-1,3-oxazolidin-2-one
CID 15117126
5-(chloromethyl)-3-(3,5-dichlorophenyl)-1,3-oxazolidin-2-one
CID 107654588
5-[2-[2-[2-[2-[2-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-3-phenyl-1,3-oxazolidin-2-one
CID 16754539
(5S)-5-(chloromethyl)-3-(3,4-dichlorophenyl)-1,3-oxazolidin-2-one
CID 51893633
5-(3-chloro-2,2,3,3-tetrafluoropropyl)-3-phenyl-1,3-oxazolidin-2-one
CID 102443365
(5R)-5-(azidomethyl)-3-phenyl-1,3-oxazolidin-2-one
CID 11458625
5-(azidomethyl)-3-phenyl-1,3-oxazolidin-2-one
CID 14011262
(5S)-3-phenyl-5-(phenylmethoxymethyl)-1,3-oxazolidin-2-one
CID 124582958
N-[[(5S)-2-oxo-3-phenyl-1,3-oxazolidin-5-yl]methyl]methanesulfonamide
CID 51453772
5-dodecyl-3-phenyl-1,3-oxazolidin-2-one
CID 23270939

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one (CID 11310370) is (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one is O=C1O[C@@H](CCl)CN1c1ccccc1.
What is the InChIKey of (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one?
The InChIKey is KARLWXPEKSFFJC-VIFPVBQESA-N. The full InChI is InChI=1S/C10H10ClNO2/c11-6-9-7-12(10(13)14-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2/t9-/m0/s1.
What are the key properties of (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one?
(5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one has a molecular weight of 211.65 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(chloromethyl)-3-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 11310370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).