2-[(5-bromo-3-pyridinyl)amino]ethanol

C7H9BrN2O — CID 91636071

IUPAC2-[(5-bromo-3-pyridinyl)amino]ethanol
SMILESOCCNc1cncc(Br)c1
InChIInChI=1S/C7H9BrN2O/c8-6-3-7(5-9-4-6)10-1-2-11/h3-5,10-11H,1-2H2
InChIKeyVAZZBFYFAPHBGP-UHFFFAOYSA-N
MW217.07 g/mol
LogP1.25
Rot. Bonds3

About 2-[(5-bromo-3-pyridinyl)amino]ethanol

2-[(5-bromo-3-pyridinyl)amino]ethanol (PubChem CID 91636071) has the molecular formula C7H9BrN2O and a molecular weight of 217.07 g/mol. Its IUPAC name is 2-[(5-bromo-3-pyridinyl)amino]ethanol.

Molecular Properties

Compound Name2-[(5-bromo-3-pyridinyl)amino]ethanol
PubChem CID91636071
Molecular FormulaC7H9BrN2O
Molecular Weight217.07 g/mol
Exact Mass215.99
IUPAC Name2-[(5-bromo-3-pyridinyl)amino]ethanol
SMILESOCCNc1cncc(Br)c1
InChIInChI=1S/C7H9BrN2O/c8-6-3-7(5-9-4-6)10-1-2-11/h3-5,10-11H,1-2H2
InChIKeyVAZZBFYFAPHBGP-UHFFFAOYSA-N
XLogP1.25
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.07
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(5-bromo-3-pyridinyl)amino]pentan-1-ol
CID 107302585
2-[[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104532515
2-[(5-amino-3-pyridinyl)amino]ethanol;hydrochloride
CID 175403125
5-bromo-N-hexylpyridin-3-amine
CID 115656852
4-[2-[(5-bromo-3-pyridinyl)amino]ethyl]phenol
CID 115682875
2-[(5-bromo-3-pyridinyl)amino]acetic acid;hydrochloride
CID 131877177
5-bromo-N-pent-4-ynylpyridin-3-amine
CID 103704408
3-[(5-bromo-3-pyridinyl)amino]-2-methylpropan-1-ol
CID 115657175
3-[(5-bromo-3-pyridinyl)amino]propane-1-sulfonamide
CID 104531690
3-[(5-bromo-3-pyridinyl)amino]-N-propylpropanamide
CID 115657144
5-bromo-N-(2-methylbutan-2-yl)pyridin-3-amine
CID 104531470
N-[2-(4-aminophenyl)ethyl]-5-bromopyridin-3-amine
CID 114194215

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-3-pyridinyl)amino]ethanol?
The IUPAC name of 2-[(5-bromo-3-pyridinyl)amino]ethanol (CID 91636071) is 2-[(5-bromo-3-pyridinyl)amino]ethanol.
What is the SMILES notation for 2-[(5-bromo-3-pyridinyl)amino]ethanol?
The canonical SMILES for 2-[(5-bromo-3-pyridinyl)amino]ethanol is OCCNc1cncc(Br)c1.
What is the InChIKey of 2-[(5-bromo-3-pyridinyl)amino]ethanol?
The InChIKey is VAZZBFYFAPHBGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2O/c8-6-3-7(5-9-4-6)10-1-2-11/h3-5,10-11H,1-2H2.
What are the key properties of 2-[(5-bromo-3-pyridinyl)amino]ethanol?
2-[(5-bromo-3-pyridinyl)amino]ethanol has a molecular weight of 217.07 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-3-pyridinyl)amino]ethanol is sourced from PubChem (CID 91636071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).