N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine

C15H20F3N — CID 106797794

IUPACN-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine
SMILESCCNC(C)C1(Cc2ccc(C(F)(F)F)cc2)CC1
InChIInChI=1S/C15H20F3N/c1-3-19-11(2)14(8-9-14)10-12-4-6-13(7-5-12)15(16,17)18/h4-7,11,19H,3,8-10H2,1-2H3
InChIKeyXTEHEKZMWCUDCP-UHFFFAOYSA-N
MW271.33 g/mol
LogP4.03
Rot. Bonds5

About N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine

N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine (PubChem CID 106797794) has the molecular formula C15H20F3N and a molecular weight of 271.33 g/mol. Its IUPAC name is N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine
PubChem CID106797794
Molecular FormulaC15H20F3N
Molecular Weight271.33 g/mol
Exact Mass271.15
IUPAC NameN-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine
SMILESCCNC(C)C1(Cc2ccc(C(F)(F)F)cc2)CC1
InChIInChI=1S/C15H20F3N/c1-3-19-11(2)14(8-9-14)10-12-4-6-13(7-5-12)15(16,17)18/h4-7,11,19H,3,8-10H2,1-2H3
InChIKeyXTEHEKZMWCUDCP-UHFFFAOYSA-N
XLogP4.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.33
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine
CID 106797601
N-[1-[1-[(4-tert-butylphenyl)methyl]cyclopropyl]ethyl]propan-1-amine
CID 106797931
1-[1-[(4-tert-butylphenyl)methyl]cyclopropyl]ethanol
CID 106798247
N-ethyl-1,1-difluoro-3-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 103516579
1-cyclobutyl-N-ethyl-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 55040821
2-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]pentan-3-amine
CID 61468668
N-ethyl-4,4-dimethyl-1-[4-(trifluoromethyl)phenyl]pentan-3-amine
CID 63399897
N-ethyl-5,5,5-trifluoro-1-[4-(trifluoromethyl)phenyl]pentan-2-amine
CID 79954040
1-(2,3-dihydrofuran-5-yl)-N-ethyl-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 102653265
N,4-diethyl-1-[4-(trifluoromethyl)phenyl]hexan-2-amine
CID 105028045
(2S)-2-(ethylamino)-3-[4-(trifluoromethyl)phenyl]propanoic acid
CID 175779531
N-ethyl-1-[4-(trifluoromethyl)phenyl]prop-2-en-1-amine
CID 105000583

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine?
The IUPAC name of N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine (CID 106797794) is N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine is CCNC(C)C1(Cc2ccc(C(F)(F)F)cc2)CC1.
What is the InChIKey of N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine?
The InChIKey is XTEHEKZMWCUDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3N/c1-3-19-11(2)14(8-9-14)10-12-4-6-13(7-5-12)15(16,17)18/h4-7,11,19H,3,8-10H2,1-2H3.
What are the key properties of N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine?
N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine has a molecular weight of 271.33 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropyl]ethanamine is sourced from PubChem (CID 106797794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).