N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline

C15H20F3N — CID 10778520

IUPACN-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline
SMILESCCN(c1ccc(C(F)(F)F)cc1)C1CCCCC1
InChIInChI=1S/C15H20F3N/c1-2-19(13-6-4-3-5-7-13)14-10-8-12(9-11-14)15(16,17)18/h8-11,13H,2-7H2,1H3
InChIKeyJPPHVPDOENWFJI-UHFFFAOYSA-N
MW271.33 g/mol
LogP4.86
Rot. Bonds3

About N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline

N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline (PubChem CID 10778520) has the molecular formula C15H20F3N and a molecular weight of 271.33 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline
PubChem CID10778520
Molecular FormulaC15H20F3N
Molecular Weight271.33 g/mol
Exact Mass271.15
IUPAC NameN-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline
SMILESCCN(c1ccc(C(F)(F)F)cc1)C1CCCCC1
InChIInChI=1S/C15H20F3N/c1-2-19(13-6-4-3-5-7-13)14-10-8-12(9-11-14)15(16,17)18/h8-11,13H,2-7H2,1H3
InChIKeyJPPHVPDOENWFJI-UHFFFAOYSA-N
XLogP4.86
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.33
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline?
The IUPAC name of N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline (CID 10778520) is N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline.
What is the SMILES notation for N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline?
The canonical SMILES for N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline is CCN(c1ccc(C(F)(F)F)cc1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline?
The InChIKey is JPPHVPDOENWFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3N/c1-2-19(13-6-4-3-5-7-13)14-10-8-12(9-11-14)15(16,17)18/h8-11,13H,2-7H2,1H3.
What are the key properties of N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline?
N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline has a molecular weight of 271.33 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-4-(trifluoromethyl)aniline is sourced from PubChem (CID 10778520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).