3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline

C15H20F3NO — CID 64755472

IUPAC3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline
SMILESCCOc1cccc(NC2CCC(C(F)(F)F)CC2)c1
InChIInChI=1S/C15H20F3NO/c1-2-20-14-5-3-4-13(10-14)19-12-8-6-11(7-9-12)15(16,17)18/h3-5,10-12,19H,2,6-9H2,1H3
InChIKeyNUGPOZWUXYIEGA-UHFFFAOYSA-N
MW287.32 g/mol
LogP4.62
Rot. Bonds4

About 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline

3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline (PubChem CID 64755472) has the molecular formula C15H20F3NO and a molecular weight of 287.32 g/mol. Its IUPAC name is 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline.

Molecular Properties

Compound Name3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline
PubChem CID64755472
Molecular FormulaC15H20F3NO
Molecular Weight287.32 g/mol
Exact Mass287.15
IUPAC Name3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline
SMILESCCOc1cccc(NC2CCC(C(F)(F)F)CC2)c1
InChIInChI=1S/C15H20F3NO/c1-2-20-14-5-3-4-13(10-14)19-12-8-6-11(7-9-12)15(16,17)18/h3-5,10-12,19H,2,6-9H2,1H3
InChIKeyNUGPOZWUXYIEGA-UHFFFAOYSA-N
XLogP4.62
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline 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

3-propoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline
CID 64753647
3-(difluoromethoxy)-N-[4-(trifluoromethyl)cyclohexyl]aniline
CID 64754052
N-(3-ethoxyphenyl)-1-propylpiperidin-4-amine
CID 54864978
N-cyclopropyl-3-(2-methylpropoxy)aniline
CID 103439181
N-cyclopropyl-3-(2-methoxyethoxy)aniline
CID 103439187
3-ethoxy-N-(3,3,5,5-tetramethylcyclohexyl)aniline
CID 115998847
3-methoxy-N-[3-(trifluoromethyl)cyclohexyl]aniline
CID 64758791
2-[3-[(4-ethylcycloheptyl)amino]phenoxy]acetonitrile
CID 65084149
2-[3-[(4-ethylcyclohexyl)amino]phenoxy]acetonitrile
CID 43721135
3-(difluoromethoxy)-N-(4-propylcyclohexyl)aniline
CID 43698673
N-tert-butyl-3-ethoxyaniline
CID 58745523
N-[3-(2-methoxyethoxy)phenyl]cycloheptanamine
CID 54864785

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline?
The IUPAC name of 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline (CID 64755472) is 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline.
What is the SMILES notation for 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline?
The canonical SMILES for 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline is CCOc1cccc(NC2CCC(C(F)(F)F)CC2)c1.
What is the InChIKey of 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline?
The InChIKey is NUGPOZWUXYIEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3NO/c1-2-20-14-5-3-4-13(10-14)19-12-8-6-11(7-9-12)15(16,17)18/h3-5,10-12,19H,2,6-9H2,1H3.
What are the key properties of 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline?
3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline has a molecular weight of 287.32 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline is sourced from PubChem (CID 64755472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).