3-(2-fluorophenoxy)cyclohexan-1-amine

C12H16FNO — CID 67983879

IUPAC3-(2-fluorophenoxy)cyclohexan-1-amine
SMILESNC1CCCC(Oc2ccccc2F)C1
InChIInChI=1S/C12H16FNO/c13-11-6-1-2-7-12(11)15-10-5-3-4-9(14)8-10/h1-2,6-7,9-10H,3-5,8,14H2
InChIKeyAQBOWYXTZZKNJV-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.47
Rot. Bonds2

About 3-(2-fluorophenoxy)cyclohexan-1-amine

3-(2-fluorophenoxy)cyclohexan-1-amine (PubChem CID 67983879) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 3-(2-fluorophenoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name3-(2-fluorophenoxy)cyclohexan-1-amine
PubChem CID67983879
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name3-(2-fluorophenoxy)cyclohexan-1-amine
SMILESNC1CCCC(Oc2ccccc2F)C1
InChIInChI=1S/C12H16FNO/c13-11-6-1-2-7-12(11)15-10-5-3-4-9(14)8-10/h1-2,6-7,9-10H,3-5,8,14H2
InChIKeyAQBOWYXTZZKNJV-UHFFFAOYSA-N
XLogP2.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(2-fluorophenoxy)cyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenoxy)cyclohexan-1-amine?
The IUPAC name of 3-(2-fluorophenoxy)cyclohexan-1-amine (CID 67983879) is 3-(2-fluorophenoxy)cyclohexan-1-amine.
What is the SMILES notation for 3-(2-fluorophenoxy)cyclohexan-1-amine?
The canonical SMILES for 3-(2-fluorophenoxy)cyclohexan-1-amine is NC1CCCC(Oc2ccccc2F)C1.
What is the InChIKey of 3-(2-fluorophenoxy)cyclohexan-1-amine?
The InChIKey is AQBOWYXTZZKNJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-11-6-1-2-7-12(11)15-10-5-3-4-9(14)8-10/h1-2,6-7,9-10H,3-5,8,14H2.
What are the key properties of 3-(2-fluorophenoxy)cyclohexan-1-amine?
3-(2-fluorophenoxy)cyclohexan-1-amine has a molecular weight of 209.26 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenoxy)cyclohexan-1-amine is sourced from PubChem (CID 67983879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).