2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol

C10H15FN2O — CID 62734185

IUPAC2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol
SMILESCCCN(CCO)c1ncccc1F
InChIInChI=1S/C10H15FN2O/c1-2-6-13(7-8-14)10-9(11)4-3-5-12-10/h3-5,14H,2,6-8H2,1H3
InChIKeyBBBGAIFKTXULCB-UHFFFAOYSA-N
MW198.24 g/mol
LogP1.43
Rot. Bonds5

About 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol

2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol (PubChem CID 62734185) has the molecular formula C10H15FN2O and a molecular weight of 198.24 g/mol. Its IUPAC name is 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol.

Molecular Properties

Compound Name2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol
PubChem CID62734185
Molecular FormulaC10H15FN2O
Molecular Weight198.24 g/mol
Exact Mass198.12
IUPAC Name2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol
SMILESCCCN(CCO)c1ncccc1F
InChIInChI=1S/C10H15FN2O/c1-2-6-13(7-8-14)10-9(11)4-3-5-12-10/h3-5,14H,2,6-8H2,1H3
InChIKeyBBBGAIFKTXULCB-UHFFFAOYSA-N
XLogP1.43
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.24
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol?
The IUPAC name of 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol (CID 62734185) is 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol.
What is the SMILES notation for 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol?
The canonical SMILES for 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol is CCCN(CCO)c1ncccc1F.
What is the InChIKey of 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol?
The InChIKey is BBBGAIFKTXULCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O/c1-2-6-13(7-8-14)10-9(11)4-3-5-12-10/h3-5,14H,2,6-8H2,1H3.
What are the key properties of 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol?
2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol has a molecular weight of 198.24 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-2-pyridinyl)-propylamino]ethanol is sourced from PubChem (CID 62734185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).