4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine

C15H18F3NO — CID 10859062

IUPAC4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine
SMILESFC(F)(F)/C(=C\CCc1ccccc1)N1CCOCC1
InChIInChI=1S/C15H18F3NO/c16-15(17,18)14(19-9-11-20-12-10-19)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,8H,4,7,9-12H2/b14-8+
InChIKeyIJAIQXJGWSKKDU-RIYZIHGNSA-N
MW285.31 g/mol
LogP3.40
Rot. Bonds4

About 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine

4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine (PubChem CID 10859062) has the molecular formula C15H18F3NO and a molecular weight of 285.31 g/mol. Its IUPAC name is 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine.

Molecular Properties

Compound Name4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine
PubChem CID10859062
Molecular FormulaC15H18F3NO
Molecular Weight285.31 g/mol
Exact Mass285.13
IUPAC Name4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine
SMILESFC(F)(F)/C(=C\CCc1ccccc1)N1CCOCC1
InChIInChI=1S/C15H18F3NO/c16-15(17,18)14(19-9-11-20-12-10-19)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,8H,4,7,9-12H2/b14-8+
InChIKeyIJAIQXJGWSKKDU-RIYZIHGNSA-N
XLogP3.40
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-Phenylpropyl)morpholine
CID 782728
4-(2-Phenylethyl)morpholine
CID 411956
4-(3-Phenylprop-2-yn-1-yl)morpholine hydrochloride
CID 6456085
4-(2,2-Diphenylvinyl)morpholine
CID 415867
4-(3-Phenylprop-2-ynyl)morpholine
CID 776254
Morpholine, 4-(1-methyl-3-phenylpropyl)-
CID 200844
4-[(E)-3-phenylbut-2-enyl]morpholine;hydrochloride
CID 57402672
Cambridge id 5427248
CID 2244852
4-[(E)-3,3,3-trifluoro-1-phenylprop-1-en-2-yl]morpholine
CID 14296892
4-[(2E)-3-phenylprop-2-en-1-yl]morpholine
CID 5473932
4-[(E)-2-phenylethenyl]morpholine
CID 11063198
4-(2-Phenylprop-2-enyl)morpholine
CID 11310211

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine?
The IUPAC name of 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine (CID 10859062) is 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine.
What is the SMILES notation for 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine?
The canonical SMILES for 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine is FC(F)(F)/C(=C\CCc1ccccc1)N1CCOCC1.
What is the InChIKey of 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine?
The InChIKey is IJAIQXJGWSKKDU-RIYZIHGNSA-N. The full InChI is InChI=1S/C15H18F3NO/c16-15(17,18)14(19-9-11-20-12-10-19)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,8H,4,7,9-12H2/b14-8+.
What are the key properties of 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine?
4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine has a molecular weight of 285.31 g/mol, XLogP of 3.40, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-1,1,1-trifluoro-5-phenylpent-2-en-2-yl]morpholine is sourced from PubChem (CID 10859062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).