1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine

C16H25FN2 — CID 114832292

IUPAC1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine
SMILESCC(N)C1CCCCN1C(C)Cc1ccc(F)cc1
InChIInChI=1S/C16H25FN2/c1-12(11-14-6-8-15(17)9-7-14)19-10-4-3-5-16(19)13(2)18/h6-9,12-13,16H,3-5,10-11,18H2,1-2H3
InChIKeyGGMHFIFUCWJEBG-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.96
Rot. Bonds4

About 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine

1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine (PubChem CID 114832292) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine
PubChem CID114832292
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC Name1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine
SMILESCC(N)C1CCCCN1C(C)Cc1ccc(F)cc1
InChIInChI=1S/C16H25FN2/c1-12(11-14-6-8-15(17)9-7-14)19-10-4-3-5-16(19)13(2)18/h6-9,12-13,16H,3-5,10-11,18H2,1-2H3
InChIKeyGGMHFIFUCWJEBG-UHFFFAOYSA-N
XLogP2.96
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[2-(1-aminoethyl)piperidin-1-yl]propyl]phenol
CID 115496086
[(2S)-1-[(2R)-1-(4-fluorophenyl)propan-2-yl]pyrrolidin-2-yl]methanamine
CID 100597047
2-[2-(1-aminoethyl)piperidin-1-yl]propan-1-ol
CID 130502556
1-[1-[1-(4-ethylphenyl)ethyl]piperidin-2-yl]ethanamine
CID 63254747
2-(1-fluoroethyl)-1-[2-(4-fluorophenyl)ethyl]piperidine
CID 174404791
1-[(2S)-1-(4-fluorophenyl)propan-2-yl]piperidine-4-carboxamide
CID 40514699
1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol
CID 111106746
1-[1-[(5-fluoro-2-methoxyphenyl)methyl]piperidin-2-yl]ethanamine
CID 55168778
1-[1-[(3-fluorophenyl)methyl]piperidin-2-yl]ethanamine
CID 63254271
1-[1-(4-fluorophenyl)propan-2-yl]piperidine-4-carboxylic acid
CID 84751496
1-(4-fluorophenyl)-2-(2-propylpiperidin-1-yl)propan-1-amine
CID 107521942
1-[1-(4-fluorophenyl)propan-2-yl]-1,5-diazocane
CID 62992839

Frequently Asked Questions

What is the IUPAC name of 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine?
The IUPAC name of 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine (CID 114832292) is 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine.
What is the SMILES notation for 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine?
The canonical SMILES for 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine is CC(N)C1CCCCN1C(C)Cc1ccc(F)cc1.
What is the InChIKey of 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine?
The InChIKey is GGMHFIFUCWJEBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-12(11-14-6-8-15(17)9-7-14)19-10-4-3-5-16(19)13(2)18/h6-9,12-13,16H,3-5,10-11,18H2,1-2H3.
What are the key properties of 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine?
1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine has a molecular weight of 264.39 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[1-(4-fluorophenyl)propan-2-yl]piperidin-2-yl]ethanamine is sourced from PubChem (CID 114832292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).