Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride

C8H17ClFN — CID 200157

IUPACN-(2-fluoroethyl)cyclohexanamine;hydrochloride
SMILESC1CCC(CC1)NCCF.Cl
InChIInChI=1S/C8H16FN.ClH/c9-6-7-10-8-4-2-1-3-5-8;/h8,10H,1-7H2;1H
InChIKeyYDTKTDBYJIXYEM-UHFFFAOYSA-N
MW181.68 g/mol
LogP—
Rot. Bonds3

About Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride

Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride (PubChem CID 200157) has the molecular formula C8H17ClFN and a molecular weight of 181.68 g/mol. Its IUPAC name is N-(2-fluoroethyl)cyclohexanamine;hydrochloride.

Molecular Properties

Compound NameCyclohexylamine, N-(2-fluoroethyl)-, hydrochloride
PubChem CID200157
Molecular FormulaC8H17ClFN
Molecular Weight181.68 g/mol
Exact Mass181.10
IUPAC NameN-(2-fluoroethyl)cyclohexanamine;hydrochloride
SMILESC1CCC(CC1)NCCF.Cl
InChIInChI=1S/C8H16FN.ClH/c9-6-7-10-8-4-2-1-3-5-8;/h8,10H,1-7H2;1H
InChIKeyYDTKTDBYJIXYEM-UHFFFAOYSA-N
XLogP—
TPSA12.00 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity79

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Dicyclohexylamine
CID 7582
N-Ethyl cyclohexylamine
CID 21609
Cyclohexylisopropylamine
CID 62386
N-Cyclohexyl-1,3-propanediamine
CID 18718
N-Butyl cyclohexylamine
CID 24946
Dicyclohexylamine hydrochloride
CID 2793652
N-ethylcyclohexanamine hydrochloride
CID 162937
Dicyclohexylammonium
CID 3770554
Cyclohexanamine, N-methyl-, hydrochloride (1:1)
CID 3050118
N-hexylcyclohexanamine
CID 4991888
N-Propylcyclohexanamine
CID 19178
N-Cyclopropylcyclohexanamine
CID 20114456

Frequently Asked Questions

What is the IUPAC name of Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride?
The IUPAC name of Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride (CID 200157) is N-(2-fluoroethyl)cyclohexanamine;hydrochloride.
What is the SMILES notation for Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride?
The canonical SMILES for Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride is C1CCC(CC1)NCCF.Cl.
What is the InChIKey of Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride?
The InChIKey is YDTKTDBYJIXYEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN.ClH/c9-6-7-10-8-4-2-1-3-5-8;/h8,10H,1-7H2;1H.
What are the key properties of Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride?
Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride has a molecular weight of 181.68 g/mol, XLogP of not available, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Cyclohexylamine, N-(2-fluoroethyl)-, hydrochloride is sourced from PubChem (CID 200157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).