(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine

C14H20FN — CID 81394013

IUPAC(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine
SMILESC[C@@H](NCc1ccccc1F)C1CCCC1
InChIInChI=1S/C14H20FN/c1-11(12-6-2-3-7-12)16-10-13-8-4-5-9-14(13)15/h4-5,8-9,11-12,16H,2-3,6-7,10H2,1H3/t11-/m1/s1
InChIKeyLVCCZVDKODJNLA-LLVKDONJSA-N
MW221.32 g/mol
LogP3.49
Rot. Bonds4

About (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine

(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine (PubChem CID 81394013) has the molecular formula C14H20FN and a molecular weight of 221.32 g/mol. Its IUPAC name is (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine
PubChem CID81394013
Molecular FormulaC14H20FN
Molecular Weight221.32 g/mol
Exact Mass221.16
IUPAC Name(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine
SMILESC[C@@H](NCc1ccccc1F)C1CCCC1
InChIInChI=1S/C14H20FN/c1-11(12-6-2-3-7-12)16-10-13-8-4-5-9-14(13)15/h4-5,8-9,11-12,16H,2-3,6-7,10H2,1H3/t11-/m1/s1
InChIKeyLVCCZVDKODJNLA-LLVKDONJSA-N
XLogP3.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[[[(1S)-1-cyclopentylethyl]amino]methyl]phenol
CID 81386738
1-cyclopentyl-N-[(2,5-difluorophenyl)methyl]ethanamine
CID 63794443
N-[(2-bromophenyl)methyl]-1-cyclopentylethanamine
CID 62632119
N-[(2-bromophenyl)methyl]-1-cyclohexylethanamine
CID 63453704
1-cyclohexyl-N-(naphthalen-1-ylmethyl)ethanamine
CID 63477824
(1R)-1-cyclopentyl-N-[[2-(methoxymethyl)phenyl]methyl]ethanamine
CID 81395717
N-[(1S)-1-cycloheptylethyl]-1-(2-fluorophenyl)propan-2-amine
CID 104979808
2-[[[(1R)-1-cyclopentylethyl]amino]methyl]benzonitrile
CID 114017957
3-[[[(1R)-1-cyclohexylethyl]amino]methyl]-4-fluorobenzonitrile
CID 81384437
3-[(1-cyclopentylethylamino)methyl]-2-fluorobenzonitrile
CID 104579614
3-[[[(1R)-1-cyclopentylethyl]amino]methyl]-4-fluorobenzoic acid
CID 107453171
N-[2-[[[(1R)-1-cyclopentylethyl]amino]methyl]phenyl]acetamide
CID 81394935

Frequently Asked Questions

What is the IUPAC name of (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine?
The IUPAC name of (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine (CID 81394013) is (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine.
What is the SMILES notation for (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine?
The canonical SMILES for (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine is C[C@@H](NCc1ccccc1F)C1CCCC1.
What is the InChIKey of (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine?
The InChIKey is LVCCZVDKODJNLA-LLVKDONJSA-N. The full InChI is InChI=1S/C14H20FN/c1-11(12-6-2-3-7-12)16-10-13-8-4-5-9-14(13)15/h4-5,8-9,11-12,16H,2-3,6-7,10H2,1H3/t11-/m1/s1.
What are the key properties of (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine?
(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine has a molecular weight of 221.32 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine is sourced from PubChem (CID 81394013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).