4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine

C14H19F2NO — CID 58812731

IUPAC4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine
SMILESNC1CCC(OCC(F)c2ccccc2F)CC1
InChIInChI=1S/C14H19F2NO/c15-13-4-2-1-3-12(13)14(16)9-18-11-7-5-10(17)6-8-11/h1-4,10-11,14H,5-9,17H2
InChIKeyOOZXPBVCWCBVDA-UHFFFAOYSA-N
MW255.31 g/mol
LogP3.12
Rot. Bonds4

About 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine

4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine (PubChem CID 58812731) has the molecular formula C14H19F2NO and a molecular weight of 255.31 g/mol. Its IUPAC name is 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine
PubChem CID58812731
Molecular FormulaC14H19F2NO
Molecular Weight255.31 g/mol
Exact Mass255.14
IUPAC Name4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine
SMILESNC1CCC(OCC(F)c2ccccc2F)CC1
InChIInChI=1S/C14H19F2NO/c15-13-4-2-1-3-12(13)14(16)9-18-11-7-5-10(17)6-8-11/h1-4,10-11,14H,5-9,17H2
InChIKeyOOZXPBVCWCBVDA-UHFFFAOYSA-N
XLogP3.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]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

Related Compounds

2-(2''-Aminoethyl)-5-benzyltetrahydrofuran
CID 11672904
4-(2-Phenylethoxy)butan-1-amine
CID 28996391
6-(2,2-Difluoro-2-phenylethoxy)-1-hexanamine
CID 50993080
trans-4-[(2R)-2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexanamine
CID 24862088
5-[Bis(4-fluorophenyl)methoxy]pentan-1-amine
CID 70682934
1-(2,4-Difluorophenyl)-3-methoxypropan-2-amine
CID 62196901
1-(2,4-Difluorophenyl)-3-ethoxypropan-2-amine
CID 65668269
(1S)-2-(4-aminocyclohexyl)oxy-1-(2-fluorophenyl)ethanol
CID 101845170
[4-[(2R)-2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexyl]azanium
CID 135075342
[1-(4-Fluorophenyl)tetrahydro-2h-pyran-4-yl]methanamine
CID 168431832
2-[5-[2-(4-Fluorophenyl)ethyl]oxolan-2-yl]ethanamine
CID 11499649
1-(4-Fluorophenyl)-4-octan-2-yloxybutan-1-amine
CID 15181367

Frequently Asked Questions

What is the IUPAC name of 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine?
The IUPAC name of 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine (CID 58812731) is 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine.
What is the SMILES notation for 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine?
The canonical SMILES for 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine is NC1CCC(OCC(F)c2ccccc2F)CC1.
What is the InChIKey of 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine?
The InChIKey is OOZXPBVCWCBVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2NO/c15-13-4-2-1-3-12(13)14(16)9-18-11-7-5-10(17)6-8-11/h1-4,10-11,14H,5-9,17H2.
What are the key properties of 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine?
4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine has a molecular weight of 255.31 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-fluoro-2-(2-fluorophenyl)ethoxy]cyclohexan-1-amine is sourced from PubChem (CID 58812731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).