(1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine

C10H20FN — CID 81384500

IUPAC(1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine
SMILESC[C@H](NCCF)C1CCCCC1
InChIInChI=1S/C10H20FN/c1-9(12-8-7-11)10-5-3-2-4-6-10/h9-10,12H,2-8H2,1H3/t9-/m0/s1
InChIKeyBVSIYHDSEBVLCJ-VIFPVBQESA-N
MW173.27 g/mol
LogP2.51
Rot. Bonds4

About (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine

(1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine (PubChem CID 81384500) has the molecular formula C10H20FN and a molecular weight of 173.27 g/mol. Its IUPAC name is (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine.

Molecular Properties

Compound Name(1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine
PubChem CID81384500
Molecular FormulaC10H20FN
Molecular Weight173.27 g/mol
Exact Mass173.16
IUPAC Name(1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine
SMILESC[C@H](NCCF)C1CCCCC1
InChIInChI=1S/C10H20FN/c1-9(12-8-7-11)10-5-3-2-4-6-10/h9-10,12H,2-8H2,1H3/t9-/m0/s1
InChIKeyBVSIYHDSEBVLCJ-VIFPVBQESA-N
XLogP2.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.27
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1-cyclohexylethyl]-3-fluoropropan-1-amine
CID 81384953
N-(1-cyclopentylethyl)-3-fluoropropan-1-amine
CID 81106948
N-[(1R)-1-cycloheptylethyl]propan-1-amine
CID 81393503
N-[(1S)-1-cyclohexylethyl]-3,3,3-trifluoropropan-1-amine
CID 81384504
N-[(1R)-1-cyclopentylethyl]propan-1-amine
CID 81395735
N-(1-cyclopentylethyl)propan-1-amine
CID 60819417
N-(2-chloroethyl)-1-cyclohexylethanamine;hydrochloride
CID 173240168
(1S)-1-cycloheptyl-N-(2-methylsulfanylethyl)ethanamine
CID 104580013
N-[(1S)-1-cycloheptylethyl]-3,3-dimethylbutan-1-amine
CID 81391072
(1S)-1-cyclohexyl-N-(2-propan-2-yloxyethyl)ethanamine
CID 81384150
(1S)-1-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine
CID 104863405
N-[(1S)-1-cyclohexylethyl]heptan-1-amine
CID 81387571

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine?
The IUPAC name of (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine (CID 81384500) is (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine.
What is the SMILES notation for (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine?
The canonical SMILES for (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine is C[C@H](NCCF)C1CCCCC1.
What is the InChIKey of (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine?
The InChIKey is BVSIYHDSEBVLCJ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H20FN/c1-9(12-8-7-11)10-5-3-2-4-6-10/h9-10,12H,2-8H2,1H3/t9-/m0/s1.
What are the key properties of (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine?
(1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine has a molecular weight of 173.27 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclohexyl-N-(2-fluoroethyl)ethanamine is sourced from PubChem (CID 81384500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).