2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine

C16H24FN — CID 43709448

IUPAC2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine
SMILESCCC1CCCCC1NC(C)c1ccccc1F
InChIInChI=1S/C16H24FN/c1-3-13-8-4-7-11-16(13)18-12(2)14-9-5-6-10-15(14)17/h5-6,9-10,12-13,16,18H,3-4,7-8,11H2,1-2H3
InChIKeyHIRSYFMMYIHTDP-UHFFFAOYSA-N
MW249.37 g/mol
LogP4.45
Rot. Bonds4

About 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine

2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine (PubChem CID 43709448) has the molecular formula C16H24FN and a molecular weight of 249.37 g/mol. Its IUPAC name is 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine
PubChem CID43709448
Molecular FormulaC16H24FN
Molecular Weight249.37 g/mol
Exact Mass249.19
IUPAC Name2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine
SMILESCCC1CCCCC1NC(C)c1ccccc1F
InChIInChI=1S/C16H24FN/c1-3-13-8-4-7-11-16(13)18-12(2)14-9-5-6-10-15(14)17/h5-6,9-10,12-13,16,18H,3-4,7-8,11H2,1-2H3
InChIKeyHIRSYFMMYIHTDP-UHFFFAOYSA-N
XLogP4.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.37
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-ethyl-1-phenylcyclohexanamine
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Dibenzylamine
CID 7656
Benzathine
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Benzfetamine
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Fendiline Hydrochloride
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Benzphetamine Hydrochloride
CID 11558159
Isopropylbenzylamine
CID 66024

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine?
The IUPAC name of 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine (CID 43709448) is 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine is CCC1CCCCC1NC(C)c1ccccc1F.
What is the InChIKey of 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine?
The InChIKey is HIRSYFMMYIHTDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN/c1-3-13-8-4-7-11-16(13)18-12(2)14-9-5-6-10-15(14)17/h5-6,9-10,12-13,16,18H,3-4,7-8,11H2,1-2H3.
What are the key properties of 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine?
2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine has a molecular weight of 249.37 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[1-(2-fluorophenyl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 43709448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).