2-(2-bromophenyl)-5-methyl-1,3-oxazolidine

C10H12BrNO — CID 82293279

IUPAC2-(2-bromophenyl)-5-methyl-1,3-oxazolidine
SMILESCC1CNC(c2ccccc2Br)O1
InChIInChI=1S/C10H12BrNO/c1-7-6-12-10(13-7)8-4-2-3-5-9(8)11/h2-5,7,10,12H,6H2,1H3
InChIKeyKGRCKXYFZDZLGS-UHFFFAOYSA-N
MW242.12 g/mol
LogP2.46
Rot. Bonds1

About 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine

2-(2-bromophenyl)-5-methyl-1,3-oxazolidine (PubChem CID 82293279) has the molecular formula C10H12BrNO and a molecular weight of 242.12 g/mol. Its IUPAC name is 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine.

Molecular Properties

Compound Name2-(2-bromophenyl)-5-methyl-1,3-oxazolidine
PubChem CID82293279
Molecular FormulaC10H12BrNO
Molecular Weight242.12 g/mol
Exact Mass241.01
IUPAC Name2-(2-bromophenyl)-5-methyl-1,3-oxazolidine
SMILESCC1CNC(c2ccccc2Br)O1
InChIInChI=1S/C10H12BrNO/c1-7-6-12-10(13-7)8-4-2-3-5-9(8)11/h2-5,7,10,12H,6H2,1H3
InChIKeyKGRCKXYFZDZLGS-UHFFFAOYSA-N
XLogP2.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.12
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,5S)-2-(2-bromophenyl)-5-methylpiperidine
CID 171755990
2-(2-bromophenyl)-1,3-oxazinane
CID 82293281
2-(2-bromophenyl)-5-methyl-1,4-oxazepane
CID 83188100
2-(2-bromophenyl)-4,5,6,6a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyrrole
CID 115062551
2-(3-chlorophenyl)-5-methyl-1,3-oxazolidine
CID 82282088
2-(2-bromophenyl)imidazolidine
CID 10331308
1-bromo-2-[(1S,2S)-2-methylcyclopropyl]benzene
CID 99867115
2-(5-chlorofuran-2-yl)-5-methyl-1,3-oxazolidine
CID 117228950
4-(2-bromophenyl)-1,2-oxazolidine
CID 105485151
2-(3-methoxyphenyl)-5-methyl-1,3-oxazolidine
CID 82281613
(2S)-2-(2-bromophenyl)oxirane
CID 30071402
3-(2-bromophenyl)-7-methyl-1,4-thiazepane 1-oxide
CID 66227384

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine?
The IUPAC name of 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine (CID 82293279) is 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine.
What is the SMILES notation for 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine?
The canonical SMILES for 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine is CC1CNC(c2ccccc2Br)O1.
What is the InChIKey of 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine?
The InChIKey is KGRCKXYFZDZLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO/c1-7-6-12-10(13-7)8-4-2-3-5-9(8)11/h2-5,7,10,12H,6H2,1H3.
What are the key properties of 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine?
2-(2-bromophenyl)-5-methyl-1,3-oxazolidine has a molecular weight of 242.12 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-5-methyl-1,3-oxazolidine is sourced from PubChem (CID 82293279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).