2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine

C14H22FN3 — CID 83124823

IUPAC2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine
SMILESCC(c1ccc(F)cn1)N1CCC(CCN)CC1
InChIInChI=1S/C14H22FN3/c1-11(14-3-2-13(15)10-17-14)18-8-5-12(4-7-16)6-9-18/h2-3,10-12H,4-9,16H2,1H3
InChIKeyUCUGFIQRWSUKLG-UHFFFAOYSA-N
MW251.35 g/mol
LogP2.34
Rot. Bonds4

About 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine

2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine (PubChem CID 83124823) has the molecular formula C14H22FN3 and a molecular weight of 251.35 g/mol. Its IUPAC name is 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine.

Molecular Properties

Compound Name2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine
PubChem CID83124823
Molecular FormulaC14H22FN3
Molecular Weight251.35 g/mol
Exact Mass251.18
IUPAC Name2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine
SMILESCC(c1ccc(F)cn1)N1CCC(CCN)CC1
InChIInChI=1S/C14H22FN3/c1-11(14-3-2-13(15)10-17-14)18-8-5-12(4-7-16)6-9-18/h2-3,10-12H,4-9,16H2,1H3
InChIKeyUCUGFIQRWSUKLG-UHFFFAOYSA-N
XLogP2.34
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]-N-methylmethanamine
CID 83124667
1-[1-[1-(5-fluoro-2-pyridinyl)ethyl]pyrrolidin-3-yl]piperidin-4-amine
CID 83109808
1-[1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-4-yl]-N-methylmethanamine
CID 112585626
2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-2-yl]-N-methylethanamine
CID 83124982
2-[1-(3,5-difluoro-2-pyridinyl)piperidin-4-yl]ethanamine
CID 112676170
1-[1-(5-fluoro-2-pyridinyl)propyl]piperidin-3-amine
CID 112585618
2-[1-(5-fluoropyrimidin-2-yl)pyrrolidin-3-yl]ethanamine
CID 114802329
[(3R)-1-[(1S)-1-pyridin-2-ylethyl]pyrrolidin-3-yl]methanamine
CID 93096967
(1R)-1-[5-(4-propylpiperidin-1-yl)-2-pyridinyl]ethanamine
CID 83122530
2-[1-(5-propan-2-yl-2-pyridinyl)piperidin-4-yl]ethanamine
CID 141263787
1-[1-(5-fluoro-2-pyridinyl)ethyl]-3-methylpyrrolidine-3-carboxylic acid
CID 83129243
1-cyclopropyl-N-[1-(5-fluoro-2-pyridinyl)ethyl]propan-2-amine
CID 83119407

Frequently Asked Questions

What is the IUPAC name of 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine?
The IUPAC name of 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine (CID 83124823) is 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine.
What is the SMILES notation for 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine?
The canonical SMILES for 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine is CC(c1ccc(F)cn1)N1CCC(CCN)CC1.
What is the InChIKey of 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine?
The InChIKey is UCUGFIQRWSUKLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22FN3/c1-11(14-3-2-13(15)10-17-14)18-8-5-12(4-7-16)6-9-18/h2-3,10-12H,4-9,16H2,1H3.
What are the key properties of 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine?
2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine has a molecular weight of 251.35 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[1-(5-fluoro-2-pyridinyl)ethyl]piperidin-4-yl]ethanamine is sourced from PubChem (CID 83124823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).