2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol

C11H17FN2O — CID 138472981

IUPAC2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol
SMILESCC(C)(C)NCC(O)c1ccc(F)cn1
InChIInChI=1S/C11H17FN2O/c1-11(2,3)14-7-10(15)9-5-4-8(12)6-13-9/h4-6,10,14-15H,7H2,1-3H3
InChIKeyFEYHZZDRBBHTDF-UHFFFAOYSA-N
MW212.27 g/mol
LogP1.64
Rot. Bonds3

About 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol

2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol (PubChem CID 138472981) has the molecular formula C11H17FN2O and a molecular weight of 212.27 g/mol. Its IUPAC name is 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol
PubChem CID138472981
Molecular FormulaC11H17FN2O
Molecular Weight212.27 g/mol
Exact Mass212.13
IUPAC Name2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol
SMILESCC(C)(C)NCC(O)c1ccc(F)cn1
InChIInChI=1S/C11H17FN2O/c1-11(2,3)14-7-10(15)9-5-4-8(12)6-13-9/h4-6,10,14-15H,7H2,1-3H3
InChIKeyFEYHZZDRBBHTDF-UHFFFAOYSA-N
XLogP1.64
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-(tert-butylamino)-1-(5-methyl-2-pyridinyl)ethanol;sulfane
CID 157303923
4,4,4-trifluoro-1-(5-fluoro-2-pyridinyl)butan-1-ol
CID 79722278
(1R)-2-amino-1-(5-fluoro-2-pyridinyl)ethanol
CID 83128440
1-(5-fluoro-2-pyridinyl)-4-methylpent-4-en-1-ol
CID 114473963
3-[2,2-dimethylpropyl(methyl)amino]-1-(5-fluoro-2-pyridinyl)propan-1-ol
CID 83126379
2-(tert-butylamino)-1-(2,4-difluorophenyl)ethanol
CID 60900936
[(2S)-2-(5-fluoro-2-pyridinyl)-2-hydroxyethyl] methanesulfonate
CID 89392644
(1S)-2-(tert-butylamino)-1-(8-fluoroquinolin-2-yl)ethanol;sulfane
CID 167620692
2-(tert-butylamino)-1-[5-methyl-6-(trifluoromethyl)-2-pyridinyl]ethanol
CID 155701455
1-(5-fluoro-2-pyridinyl)-2-pyridin-4-ylethanol
CID 79723827
2,2-difluoro-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83119275
1-[1-(5-fluoro-2-pyridinyl)ethylamino]-2-methylbutan-2-ol
CID 83118832

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol?
The IUPAC name of 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol (CID 138472981) is 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol.
What is the SMILES notation for 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol?
The canonical SMILES for 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol is CC(C)(C)NCC(O)c1ccc(F)cn1.
What is the InChIKey of 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol?
The InChIKey is FEYHZZDRBBHTDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2O/c1-11(2,3)14-7-10(15)9-5-4-8(12)6-13-9/h4-6,10,14-15H,7H2,1-3H3.
What are the key properties of 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol?
2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol has a molecular weight of 212.27 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-1-(5-fluoro-2-pyridinyl)ethanol is sourced from PubChem (CID 138472981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).