1-(3-fluoropiperidin-4-yl)ethanamine

C7H15FN2 — CID 178035088

IUPAC1-(3-fluoropiperidin-4-yl)ethanamine
SMILESCC(N)C1CCNCC1F
InChIInChI=1S/C7H15FN2/c1-5(9)6-2-3-10-4-7(6)8/h5-7,10H,2-4,9H2,1H3
InChIKeyAHLKBWXMWWJIBK-UHFFFAOYSA-N
MW146.21 g/mol
LogP0.28
Rot. Bonds1

About 1-(3-fluoropiperidin-4-yl)ethanamine

1-(3-fluoropiperidin-4-yl)ethanamine (PubChem CID 178035088) has the molecular formula C7H15FN2 and a molecular weight of 146.21 g/mol. Its IUPAC name is 1-(3-fluoropiperidin-4-yl)ethanamine.

Molecular Properties

Compound Name1-(3-fluoropiperidin-4-yl)ethanamine
PubChem CID178035088
Molecular FormulaC7H15FN2
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC Name1-(3-fluoropiperidin-4-yl)ethanamine
SMILESCC(N)C1CCNCC1F
InChIInChI=1S/C7H15FN2/c1-5(9)6-2-3-10-4-7(6)8/h5-7,10H,2-4,9H2,1H3
InChIKeyAHLKBWXMWWJIBK-UHFFFAOYSA-N
XLogP0.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,4R)-3-fluoro-4-propan-2-ylpiperidine
CID 168979168
1-(4-fluoropyrrolidin-3-yl)ethanamine
CID 57015274
3-fluoro-N-propan-2-ylpiperidin-4-amine
CID 59304222
(3R,4S)-3-fluoropiperidin-4-amine;hydrochloride
CID 170923054
3-methyl-4-propan-2-ylpiperidine
CID 58394699
1-[2-(1-aminoethyl)cyclobutyl]ethanamine
CID 22627804
(3S,4R)-4-fluoro-N-propan-2-ylpiperidin-3-amine
CID 164821452
(3S,4R)-3-fluoro-4-methylsulfanylpiperidine
CID 118661743
(3R)-3-fluoro-N-methylpiperidin-4-amine
CID 141385333
(3R)-3-fluoro-4-methoxypiperidine
CID 175540889
(3S,4R)-4-fluoropiperidin-3-amine
CID 97053659
(3S,4S)-3-fluoro-4-methoxypiperidine;hydrochloride
CID 135395865

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropiperidin-4-yl)ethanamine?
The IUPAC name of 1-(3-fluoropiperidin-4-yl)ethanamine (CID 178035088) is 1-(3-fluoropiperidin-4-yl)ethanamine.
What is the SMILES notation for 1-(3-fluoropiperidin-4-yl)ethanamine?
The canonical SMILES for 1-(3-fluoropiperidin-4-yl)ethanamine is CC(N)C1CCNCC1F.
What is the InChIKey of 1-(3-fluoropiperidin-4-yl)ethanamine?
The InChIKey is AHLKBWXMWWJIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2/c1-5(9)6-2-3-10-4-7(6)8/h5-7,10H,2-4,9H2,1H3.
What are the key properties of 1-(3-fluoropiperidin-4-yl)ethanamine?
1-(3-fluoropiperidin-4-yl)ethanamine has a molecular weight of 146.21 g/mol, XLogP of 0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropiperidin-4-yl)ethanamine is sourced from PubChem (CID 178035088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).