(2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol

C9H11Br2NO — CID 131062673

IUPAC(2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol
SMILESCN[C@@H](CO)c1cc(Br)ccc1Br
InChIInChI=1S/C9H11Br2NO/c1-12-9(5-13)7-4-6(10)2-3-8(7)11/h2-4,9,12-13H,5H2,1H3/t9-/m0/s1
InChIKeySUOISUHHIXKLFA-VIFPVBQESA-N
MW309.00 g/mol
LogP2.46
Rot. Bonds3

About (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol

(2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol (PubChem CID 131062673) has the molecular formula C9H11Br2NO and a molecular weight of 309.00 g/mol. Its IUPAC name is (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol.

Molecular Properties

Compound Name(2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol
PubChem CID131062673
Molecular FormulaC9H11Br2NO
Molecular Weight309.00 g/mol
Exact Mass306.92
IUPAC Name(2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol
SMILESCN[C@@H](CO)c1cc(Br)ccc1Br
InChIInChI=1S/C9H11Br2NO/c1-12-9(5-13)7-4-6(10)2-3-8(7)11/h2-4,9,12-13H,5H2,1H3/t9-/m0/s1
InChIKeySUOISUHHIXKLFA-VIFPVBQESA-N
XLogP2.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.00
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-5-methoxyphenyl)-2-(methylamino)ethanol
CID 103845987
1-(2,5-dibromophenyl)-N-methylpent-4-yn-1-amine
CID 115859658
(2S)-2-(2-bromophenyl)-2-(methylamino)ethanol
CID 93471242
1-(2,5-dibromophenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 43482204
2-(4-bromothiophen-2-yl)-1-(2,5-dibromophenyl)-N-methylethanamine
CID 115848058
1-(2,5-dibromophenyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 115844386
2-(2-bromo-5-methoxyphenyl)-1-(2,5-dibromophenyl)-N-methylethanamine
CID 115862414
1-(2,5-dibromophenyl)-N-methyl-3-thiophen-2-ylpropan-1-amine
CID 115861201
1-(2,5-dibromophenyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103556161
2-(3-bromo-4-methoxyphenyl)-1-(2,5-dibromophenyl)-N-methylethanamine
CID 115818264
2-bromo-6-[(1S)-2-hydroxy-1-(methylamino)ethyl]phenol
CID 130741127
1-(2-bromo-5-methylphenyl)-2-(4-bromophenyl)-N-methylethanamine
CID 81112448

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol?
The IUPAC name of (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol (CID 131062673) is (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol.
What is the SMILES notation for (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol?
The canonical SMILES for (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol is CN[C@@H](CO)c1cc(Br)ccc1Br.
What is the InChIKey of (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol?
The InChIKey is SUOISUHHIXKLFA-VIFPVBQESA-N. The full InChI is InChI=1S/C9H11Br2NO/c1-12-9(5-13)7-4-6(10)2-3-8(7)11/h2-4,9,12-13H,5H2,1H3/t9-/m0/s1.
What are the key properties of (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol?
(2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol has a molecular weight of 309.00 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,5-dibromophenyl)-2-(methylamino)ethanol is sourced from PubChem (CID 131062673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).