2-(4-fluorophenoxy)cyclohexan-1-amine

C12H16FNO — CID 45283445

IUPAC2-(4-fluorophenoxy)cyclohexan-1-amine
SMILESNC1CCCCC1Oc1ccc(F)cc1
InChIInChI=1S/C12H16FNO/c13-9-5-7-10(8-6-9)15-12-4-2-1-3-11(12)14/h5-8,11-12H,1-4,14H2
InChIKeyIOIVLHZNPOACPZ-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.47
Rot. Bonds2

About 2-(4-fluorophenoxy)cyclohexan-1-amine

2-(4-fluorophenoxy)cyclohexan-1-amine (PubChem CID 45283445) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name2-(4-fluorophenoxy)cyclohexan-1-amine
PubChem CID45283445
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name2-(4-fluorophenoxy)cyclohexan-1-amine
SMILESNC1CCCCC1Oc1ccc(F)cc1
InChIInChI=1S/C12H16FNO/c13-9-5-7-10(8-6-9)15-12-4-2-1-3-11(12)14/h5-8,11-12H,1-4,14H2
InChIKeyIOIVLHZNPOACPZ-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

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Related Compounds

2-(4-Phenoxyphenoxy)ethanamine
CID 11031651
2-Phenoxyethanamine
CID 15651
1-Phenoxy-2-propanamine
CID 37087
(3-Phenoxypropyl)amine
CID 418237
3-(4-Fluorophenoxy)propan-1-amine
CID 14025825
(E)-3-fluoro-4-phenoxybut-2-en-1-amine
CID 42624010
(E)-4-(3,4-difluorophenoxy)-3-fluorobut-2-en-1-amine
CID 42624093
(E)-3-fluoro-4-(4-phenoxyphenoxy)but-2-en-1-amine
CID 42624190
(S)-2-((4-(4-fluorophenoxy)phenoxy)methyl)piperidine
CID 46888145
4-(4-Fluorophenoxy)butan-1-amine
CID 7131478
4-Phenoxybutan-1-amine
CID 116240
(S)-2-(3-Fluoro-phenoxymethyl)-pyrrolidine
CID 44313186

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)cyclohexan-1-amine?
The IUPAC name of 2-(4-fluorophenoxy)cyclohexan-1-amine (CID 45283445) is 2-(4-fluorophenoxy)cyclohexan-1-amine.
What is the SMILES notation for 2-(4-fluorophenoxy)cyclohexan-1-amine?
The canonical SMILES for 2-(4-fluorophenoxy)cyclohexan-1-amine is NC1CCCCC1Oc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)cyclohexan-1-amine?
The InChIKey is IOIVLHZNPOACPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-9-5-7-10(8-6-9)15-12-4-2-1-3-11(12)14/h5-8,11-12H,1-4,14H2.
What are the key properties of 2-(4-fluorophenoxy)cyclohexan-1-amine?
2-(4-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 2-(4-fluorophenoxy)cyclohexan-1-amine is sourced from PubChem (CID 45283445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).