2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol

C11H17FN2O — CID 61447347

IUPAC2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol
SMILESCCCCN(CCO)c1cccc(F)n1
InChIInChI=1S/C11H17FN2O/c1-2-3-7-14(8-9-15)11-6-4-5-10(12)13-11/h4-6,15H,2-3,7-9H2,1H3
InChIKeyAADPMPMMWXXICY-UHFFFAOYSA-N
MW212.27 g/mol
LogP1.82
Rot. Bonds6

About 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol

2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol (PubChem CID 61447347) has the molecular formula C11H17FN2O and a molecular weight of 212.27 g/mol. Its IUPAC name is 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol.

Molecular Properties

Compound Name2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol
PubChem CID61447347
Molecular FormulaC11H17FN2O
Molecular Weight212.27 g/mol
Exact Mass212.13
IUPAC Name2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol
SMILESCCCCN(CCO)c1cccc(F)n1
InChIInChI=1S/C11H17FN2O/c1-2-3-7-14(8-9-15)11-6-4-5-10(12)13-11/h4-6,15H,2-3,7-9H2,1H3
InChIKeyAADPMPMMWXXICY-UHFFFAOYSA-N
XLogP1.82
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-[butyl-(6-ethoxy-2-pyridinyl)amino]ethanol
CID 55212591
2-[(6-fluoro-2-pyridinyl)-methylamino]ethanol
CID 61229567
6-bromo-N,N-dibutylpyridin-2-amine
CID 63961710
2-[(2-aminopyrimidin-4-yl)-butylamino]ethanol
CID 80808960
6-fluoro-N-methyl-N-pentylpyridin-2-amine
CID 61230318
2-[2-hydroxyethyl-[6-(propylamino)-2-pyridinyl]amino]ethanol
CID 80797618
2-[2-[(1S)-1-aminoethyl]-N-butyl-3-fluoroanilino]ethanol
CID 78934634
3-amino-6-[butyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile
CID 103467827
2-(N-butyl-2,3,4,5,6-pentafluoroanilino)ethanol
CID 61447886
N,N-dibutylquinolin-2-amine
CID 125488581
2-[butyl-(5-methoxy-2-pyridinyl)amino]ethanol
CID 106504640
6-N-butyl-6-N-ethyl-2-N-methylpyridine-2,6-diamine
CID 80754350

Frequently Asked Questions

What is the IUPAC name of 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol?
The IUPAC name of 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol (CID 61447347) is 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol.
What is the SMILES notation for 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol?
The canonical SMILES for 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol is CCCCN(CCO)c1cccc(F)n1.
What is the InChIKey of 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol?
The InChIKey is AADPMPMMWXXICY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2O/c1-2-3-7-14(8-9-15)11-6-4-5-10(12)13-11/h4-6,15H,2-3,7-9H2,1H3.
What are the key properties of 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol?
2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol has a molecular weight of 212.27 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-(6-fluoro-2-pyridinyl)amino]ethanol is sourced from PubChem (CID 61447347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).