2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol

C13H14BrNO — CID 132597175

IUPAC2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol
SMILESCN(CCO)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C13H14BrNO/c1-15(6-7-16)13-5-3-10-8-12(14)4-2-11(10)9-13/h2-5,8-9,16H,6-7H2,1H3
InChIKeyZGXYNJCHYMKRFL-UHFFFAOYSA-N
MW280.17 g/mol
LogP3.03
Rot. Bonds3

About 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol

2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol (PubChem CID 132597175) has the molecular formula C13H14BrNO and a molecular weight of 280.17 g/mol. Its IUPAC name is 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol.

Molecular Properties

Compound Name2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol
PubChem CID132597175
Molecular FormulaC13H14BrNO
Molecular Weight280.17 g/mol
Exact Mass279.03
IUPAC Name2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol
SMILESCN(CCO)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C13H14BrNO/c1-15(6-7-16)13-5-3-10-8-12(14)4-2-11(10)9-13/h2-5,8-9,16H,6-7H2,1H3
InChIKeyZGXYNJCHYMKRFL-UHFFFAOYSA-N
XLogP3.03
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.17
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-N,3-dimethylanilino)ethanol
CID 82117999
2-[4-(aminomethyl)-3-bromo-N-methylanilino]ethanol
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7-[2-hydroxyethyl(methyl)amino]chromen-2-one
CID 87789363
6-bromo-N-(5-hydroxypentyl)-N-methylnaphthalene-2-carboxamide
CID 107199939
2,6-dibromonaphthalene
CID 640591
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CID 60961571
2-[1,3-benzodioxol-5-yl(methyl)amino]ethanol
CID 82112129
2-[N-methyl-4-(4-methylphenyl)anilino]ethanol
CID 134375637
3-(3-bromo-N,4-dimethylanilino)propan-1-ol
CID 82120880
2-(4-ethylsulfanyl-N-methylanilino)ethanol
CID 115216147
2-[3-bromo-N-methyl-4-(propylaminomethyl)anilino]ethanol
CID 114060727

Frequently Asked Questions

What is the IUPAC name of 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol?
The IUPAC name of 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol (CID 132597175) is 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol.
What is the SMILES notation for 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol?
The canonical SMILES for 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol is CN(CCO)c1ccc2cc(Br)ccc2c1.
What is the InChIKey of 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol?
The InChIKey is ZGXYNJCHYMKRFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrNO/c1-15(6-7-16)13-5-3-10-8-12(14)4-2-11(10)9-13/h2-5,8-9,16H,6-7H2,1H3.
What are the key properties of 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol?
2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol has a molecular weight of 280.17 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-bromonaphthalen-2-yl)-methylamino]ethanol is sourced from PubChem (CID 132597175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).