2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol

C11H16BrNO3 — CID 66490760

IUPAC2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol
SMILESCOc1ccc(Br)cc1C(CO)NCCO
InChIInChI=1S/C11H16BrNO3/c1-16-11-3-2-8(12)6-9(11)10(7-15)13-4-5-14/h2-3,6,10,13-15H,4-5,7H2,1H3
InChIKeyQPSUZWQOAJOSRS-UHFFFAOYSA-N
MW290.16 g/mol
LogP1.07
Rot. Bonds6

About 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol

2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol (PubChem CID 66490760) has the molecular formula C11H16BrNO3 and a molecular weight of 290.16 g/mol. Its IUPAC name is 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol.

Molecular Properties

Compound Name2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol
PubChem CID66490760
Molecular FormulaC11H16BrNO3
Molecular Weight290.16 g/mol
Exact Mass289.03
IUPAC Name2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol
SMILESCOc1ccc(Br)cc1C(CO)NCCO
InChIInChI=1S/C11H16BrNO3/c1-16-11-3-2-8(12)6-9(11)10(7-15)13-4-5-14/h2-3,6,10,13-15H,4-5,7H2,1H3
InChIKeyQPSUZWQOAJOSRS-UHFFFAOYSA-N
XLogP1.07
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.16
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-bromo-2-methoxyphenyl)-2-(butan-2-ylamino)ethanol
CID 61050211
(2R)-2-amino-2-(5-bromo-2-methoxyphenyl)ethanol
CID 66515416
2-(4-bromoanilino)-2-(2,5-dimethoxyphenyl)ethanol
CID 61048862
1-(5-bromo-2-methoxyphenyl)-3,3-dimethyl-N-propylbutan-1-amine
CID 43493922
1-[1-(5-bromo-2-methoxyphenyl)-2-hydroxyethyl]-3-tert-butylurea
CID 86779098
4-(5-bromo-2-methoxyphenyl)-4-(methylamino)butan-2-one
CID 116956001
1-(5-bromo-2-methoxyphenyl)-N-[(E)-pent-3-enyl]ethane-1,2-diamine
CID 113465486
N-[1-(5-bromo-2-methoxyphenyl)ethyl]hydroxylamine
CID 130061479
(5-bromo-2-methoxyphenyl)-(methylamino)methanol
CID 116954641
2-amino-1-(5-bromo-2-methoxyphenyl)butane-1,4-diol
CID 83933754
(2S)-2-amino-2-(4-bromo-2-methoxyphenyl)ethanol
CID 66515456
(1S)-1-(5-bromo-2-methoxyphenyl)-2-fluoroethanamine;hydrochloride
CID 171201580

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol?
The IUPAC name of 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol (CID 66490760) is 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol.
What is the SMILES notation for 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol?
The canonical SMILES for 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol is COc1ccc(Br)cc1C(CO)NCCO.
What is the InChIKey of 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol?
The InChIKey is QPSUZWQOAJOSRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrNO3/c1-16-11-3-2-8(12)6-9(11)10(7-15)13-4-5-14/h2-3,6,10,13-15H,4-5,7H2,1H3.
What are the key properties of 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol?
2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol has a molecular weight of 290.16 g/mol, XLogP of 1.07, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-methoxyphenyl)-2-(2-hydroxyethylamino)ethanol is sourced from PubChem (CID 66490760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).