(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine

C15H22ClN — CID 81395665

IUPAC(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine
SMILESCC(N[C@H](C)C1CCCC1)c1ccccc1Cl
InChIInChI=1S/C15H22ClN/c1-11(13-7-3-4-8-13)17-12(2)14-9-5-6-10-15(14)16/h5-6,9-13,17H,3-4,7-8H2,1-2H3/t11-,12?/m1/s1
InChIKeyBQFLZDBMCHNHPT-JHJMLUEUSA-N
MW251.80 g/mol
LogP4.57
Rot. Bonds4

About (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine

(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine (PubChem CID 81395665) has the molecular formula C15H22ClN and a molecular weight of 251.80 g/mol. Its IUPAC name is (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine.

Molecular Properties

Compound Name(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine
PubChem CID81395665
Molecular FormulaC15H22ClN
Molecular Weight251.80 g/mol
Exact Mass251.14
IUPAC Name(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine
SMILESCC(N[C@H](C)C1CCCC1)c1ccccc1Cl
InChIInChI=1S/C15H22ClN/c1-11(13-7-3-4-8-13)17-12(2)14-9-5-6-10-15(14)16/h5-6,9-13,17H,3-4,7-8H2,1-2H3/t11-,12?/m1/s1
InChIKeyBQFLZDBMCHNHPT-JHJMLUEUSA-N
XLogP4.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.80
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine
CID 81384547
N-[(1R)-1-(2-chlorophenyl)ethyl]-1-(1-ethylpiperidin-4-yl)ethanamine
CID 81377394
(1S)-1-cycloheptyl-N-[1-(2-methylphenyl)ethyl]ethanamine
CID 81390722
(1R)-1-cycloheptyl-N-[1-(2,5-dichlorophenyl)ethyl]ethanamine
CID 81392727
N-[(1R)-1-(2-bromophenyl)ethyl]-1-cyclohexylethanamine
CID 81383230
(1S)-N-[1-(2-bromophenyl)ethyl]-1-cycloheptylethanamine
CID 81389871
N-[(1S)-1-(2-bromophenyl)ethyl]-1-cyclohexylethanamine
CID 81383884
N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
CID 81375624
(1S)-1-cycloheptyl-N-[1-(2,3,4-trichlorophenyl)ethyl]ethanamine
CID 81391570
(1R)-N-[1-(4-bromo-2-chlorophenyl)ethyl]-1-cyclohexylethanamine
CID 82773268
N-[1-(2-chloro-3-pyridinyl)ethyl]-1-cyclobutylethanamine
CID 115896481
N-[(1S)-1-(2-chlorophenyl)ethyl]-1-cyclobutylpropan-2-amine
CID 113489915

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine?
The IUPAC name of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine (CID 81395665) is (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine.
What is the SMILES notation for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine?
The canonical SMILES for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine is CC(N[C@H](C)C1CCCC1)c1ccccc1Cl.
What is the InChIKey of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine?
The InChIKey is BQFLZDBMCHNHPT-JHJMLUEUSA-N. The full InChI is InChI=1S/C15H22ClN/c1-11(13-7-3-4-8-13)17-12(2)14-9-5-6-10-15(14)16/h5-6,9-13,17H,3-4,7-8H2,1-2H3/t11-,12?/m1/s1.
What are the key properties of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine?
(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine has a molecular weight of 251.80 g/mol, XLogP of 4.57, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine is sourced from PubChem (CID 81395665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).