1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine

C16H25FN2 — CID 99717003

IUPAC1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine
SMILESCC[C@@H](NC1CCN(CC)CC1)c1ccccc1F
InChIInChI=1S/C16H25FN2/c1-3-16(14-7-5-6-8-15(14)17)18-13-9-11-19(4-2)12-10-13/h5-8,13,16,18H,3-4,9-12H2,1-2H3/t16-/m1/s1
InChIKeyAVAOFRGKGNAAEW-MRXNPFEDSA-N
MW264.39 g/mol
LogP3.35
Rot. Bonds5

About 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine

1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine (PubChem CID 99717003) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine
PubChem CID99717003
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC Name1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine
SMILESCC[C@@H](NC1CCN(CC)CC1)c1ccccc1F
InChIInChI=1S/C16H25FN2/c1-3-16(14-7-5-6-8-15(14)17)18-13-9-11-19(4-2)12-10-13/h5-8,13,16,18H,3-4,9-12H2,1-2H3/t16-/m1/s1
InChIKeyAVAOFRGKGNAAEW-MRXNPFEDSA-N
XLogP3.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-N-[1-(4-fluorophenyl)propyl]piperidin-4-amine
CID 54917034
N-[1-(2-fluorophenyl)propyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115994378
1-ethyl-N-(1-phenylbutyl)piperidin-4-amine
CID 43224635
2-[1-(cyclopropylamino)propyl]phenol
CID 16772826
N-benzhydryl-1-ethylpiperidin-4-amine
CID 3821522
N-[1-(2-fluorophenyl)propyl]-2-methyloxolan-3-amine
CID 112639555
N-fluoro-1-(2-fluorophenyl)propan-1-amine
CID 175319126
(3R)-3-[[(1S)-1-(2-fluorophenyl)propyl]amino]-1-(2,2,2-trifluoroethyl)pyrrolidin-2-one
CID 99820138
2-[(1R)-1-[[1-[(1S,2S)-2-hydroxycyclohexyl]piperidin-4-yl]amino]propyl]phenol
CID 99702928
1-cyclopropyl-N-[1-(2-methoxyphenyl)propyl]piperidin-4-amine
CID 43791300
N-[(1R)-1-(2-fluorophenyl)ethyl]-1-propan-2-ylpiperidin-4-amine
CID 28716756
N-[1-(2-fluorophenyl)propyl]pyrrol-1-amine
CID 112677047

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine?
The IUPAC name of 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine (CID 99717003) is 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine is CC[C@@H](NC1CCN(CC)CC1)c1ccccc1F.
What is the InChIKey of 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine?
The InChIKey is AVAOFRGKGNAAEW-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H25FN2/c1-3-16(14-7-5-6-8-15(14)17)18-13-9-11-19(4-2)12-10-13/h5-8,13,16,18H,3-4,9-12H2,1-2H3/t16-/m1/s1.
What are the key properties of 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine?
1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine has a molecular weight of 264.39 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1R)-1-(2-fluorophenyl)propyl]piperidin-4-amine is sourced from PubChem (CID 99717003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).