2-(4-fluorocyclohexyl)oxyethanamine

C8H16FNO — CID 84731500

IUPAC2-(4-fluorocyclohexyl)oxyethanamine
SMILESNCCOC1CCC(F)CC1
InChIInChI=1S/C8H16FNO/c9-7-1-3-8(4-2-7)11-6-5-10/h7-8H,1-6,10H2
InChIKeyVKCNOLPLJPZYQH-UHFFFAOYSA-N
MW161.22 g/mol
LogP1.24
Rot. Bonds3

About 2-(4-fluorocyclohexyl)oxyethanamine

2-(4-fluorocyclohexyl)oxyethanamine (PubChem CID 84731500) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 2-(4-fluorocyclohexyl)oxyethanamine.

Molecular Properties

Compound Name2-(4-fluorocyclohexyl)oxyethanamine
PubChem CID84731500
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name2-(4-fluorocyclohexyl)oxyethanamine
SMILESNCCOC1CCC(F)CC1
InChIInChI=1S/C8H16FNO/c9-7-1-3-8(4-2-7)11-6-5-10/h7-8H,1-6,10H2
InChIKeyVKCNOLPLJPZYQH-UHFFFAOYSA-N
XLogP1.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorocyclohexyl)oxyethanamine?
The IUPAC name of 2-(4-fluorocyclohexyl)oxyethanamine (CID 84731500) is 2-(4-fluorocyclohexyl)oxyethanamine.
What is the SMILES notation for 2-(4-fluorocyclohexyl)oxyethanamine?
The canonical SMILES for 2-(4-fluorocyclohexyl)oxyethanamine is NCCOC1CCC(F)CC1.
What is the InChIKey of 2-(4-fluorocyclohexyl)oxyethanamine?
The InChIKey is VKCNOLPLJPZYQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c9-7-1-3-8(4-2-7)11-6-5-10/h7-8H,1-6,10H2.
What are the key properties of 2-(4-fluorocyclohexyl)oxyethanamine?
2-(4-fluorocyclohexyl)oxyethanamine has a molecular weight of 161.22 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorocyclohexyl)oxyethanamine is sourced from PubChem (CID 84731500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).