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

C16H24ClN — CID 81384547

IUPAC(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine
SMILESCC(N[C@H](C)C1CCCCC1)c1ccccc1Cl
InChIInChI=1S/C16H24ClN/c1-12(14-8-4-3-5-9-14)18-13(2)15-10-6-7-11-16(15)17/h6-7,10-14,18H,3-5,8-9H2,1-2H3/t12-,13?/m1/s1
InChIKeyGBNIRTUWLVOIPV-PZORYLMUSA-N
MW265.83 g/mol
LogP4.96
Rot. Bonds4

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

(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine (PubChem CID 81384547) has the molecular formula C16H24ClN and a molecular weight of 265.83 g/mol. Its IUPAC name is (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine.

Molecular Properties

Compound Name(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine
PubChem CID81384547
Molecular FormulaC16H24ClN
Molecular Weight265.83 g/mol
Exact Mass265.16
IUPAC Name(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine
SMILESCC(N[C@H](C)C1CCCCC1)c1ccccc1Cl
InChIInChI=1S/C16H24ClN/c1-12(14-8-4-3-5-9-14)18-13(2)15-10-6-7-11-16(15)17/h6-7,10-14,18H,3-5,8-9H2,1-2H3/t12-,13?/m1/s1
InChIKeyGBNIRTUWLVOIPV-PZORYLMUSA-N
XLogP4.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.83
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclopentylethanamine
CID 81395665
(1S)-1-cycloheptyl-N-[1-(2-methylphenyl)ethyl]ethanamine
CID 81390722
N-[(1R)-1-(2-chlorophenyl)ethyl]-1-(1-ethylpiperidin-4-yl)ethanamine
CID 81377394
(1R)-1-cycloheptyl-N-[1-(2,5-dichlorophenyl)ethyl]ethanamine
CID 81392727
(1S)-N-[1-(2-bromophenyl)ethyl]-1-cycloheptylethanamine
CID 81389871
N-[(1R)-1-(2-bromophenyl)ethyl]-1-cyclohexylethanamine
CID 81383230
N-[(1S)-1-(2-bromophenyl)ethyl]-1-cyclohexylethanamine
CID 81383884
(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-[(1S)-1-(2-chlorophenyl)ethyl]-1-(1-propylpiperidin-3-yl)ethanamine
CID 81375624
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-cyclohexylethanamine?
The IUPAC name of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine (CID 81384547) is (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine.
What is the SMILES notation for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine?
The canonical SMILES for (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine is CC(N[C@H](C)C1CCCCC1)c1ccccc1Cl.
What is the InChIKey of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine?
The InChIKey is GBNIRTUWLVOIPV-PZORYLMUSA-N. The full InChI is InChI=1S/C16H24ClN/c1-12(14-8-4-3-5-9-14)18-13(2)15-10-6-7-11-16(15)17/h6-7,10-14,18H,3-5,8-9H2,1-2H3/t12-,13?/m1/s1.
What are the key properties of (1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine?
(1R)-N-[1-(2-chlorophenyl)ethyl]-1-cyclohexylethanamine has a molecular weight of 265.83 g/mol, XLogP of 4.96, 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-cyclohexylethanamine is sourced from PubChem (CID 81384547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).