(2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine

C11H14BrNO — CID 94035077

IUPAC(2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine
SMILESCN1CCO[C@]1(C)c1ccc(Br)cc1
InChIInChI=1S/C11H14BrNO/c1-11(13(2)7-8-14-11)9-3-5-10(12)6-4-9/h3-6H,7-8H2,1-2H3/t11-/m1/s1
InChIKeyNFYFRCXCOSJROR-LLVKDONJSA-N
MW256.14 g/mol
LogP2.58
Rot. Bonds1

About (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine

(2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine (PubChem CID 94035077) has the molecular formula C11H14BrNO and a molecular weight of 256.14 g/mol. Its IUPAC name is (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine.

Molecular Properties

Compound Name(2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine
PubChem CID94035077
Molecular FormulaC11H14BrNO
Molecular Weight256.14 g/mol
Exact Mass255.03
IUPAC Name(2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine
SMILESCN1CCO[C@]1(C)c1ccc(Br)cc1
InChIInChI=1S/C11H14BrNO/c1-11(13(2)7-8-14-11)9-3-5-10(12)6-4-9/h3-6H,7-8H2,1-2H3/t11-/m1/s1
InChIKeyNFYFRCXCOSJROR-LLVKDONJSA-N
XLogP2.58
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.14
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(4-bromophenyl)-2,4-dimethylmorpholine
CID 92968507
2-(4-bromophenyl)-2-methyl-4-propan-2-ylmorpholine;hydrochloride
CID 3066058
2-(4-bromophenyl)-2-methyl-1,3-oxathiolane
CID 548298
4-(4-bromophenyl)-1-methyl-2,6,7-trioxabicyclo[2.2.2]octane
CID 67492225
2-(4-bromophenyl)ethenyl 2,2-dimethyl-1,3-oxazolidine-3-carboxylate
CID 151318040
4-(5-bromo-2-pyridinyl)-2,2-dimethylmorpholine
CID 61375097
1-(4-bromophenyl)-2,2-dimethylcyclopropane-1-carbonitrile
CID 82382874
(2S)-3-benzyl-2-methyl-2-phenyl-1,3-oxazolidine
CID 101229912
4-(4-bromophenyl)-4-methoxy-1-methylpiperidine
CID 58266743
2-(4-bromophenyl)-2-(chloromethyl)-1,3-dioxolane
CID 82124190
2,3-dimethyl-1,3-oxazolidin-2-amine
CID 67867295
1-(4-bromophenyl)-4-(3-methyloxetan-3-yl)piperazine
CID 176829552

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine?
The IUPAC name of (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine (CID 94035077) is (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine.
What is the SMILES notation for (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine?
The canonical SMILES for (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine is CN1CCO[C@]1(C)c1ccc(Br)cc1.
What is the InChIKey of (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine?
The InChIKey is NFYFRCXCOSJROR-LLVKDONJSA-N. The full InChI is InChI=1S/C11H14BrNO/c1-11(13(2)7-8-14-11)9-3-5-10(12)6-4-9/h3-6H,7-8H2,1-2H3/t11-/m1/s1.
What are the key properties of (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine?
(2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine has a molecular weight of 256.14 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-bromophenyl)-2,3-dimethyl-1,3-oxazolidine is sourced from PubChem (CID 94035077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).