(E)-N-(1-phenylethyl)hex-2-en-1-imine

C14H19N — CID 11401417

IUPAC(E)-N-(1-phenylethyl)hex-2-en-1-imine
SMILESCCC/C=C/C=N/C(C)c1ccccc1
InChIInChI=1S/C14H19N/c1-3-4-5-9-12-15-13(2)14-10-7-6-8-11-14/h5-13H,3-4H2,1-2H3/b9-5+,15-12+
InChIKeyPFZHQCYZAPJSBT-KJCDSFJNSA-N
MW201.31 g/mol
LogP4.17
Rot. Bonds5

About (E)-N-(1-phenylethyl)hex-2-en-1-imine

(E)-N-(1-phenylethyl)hex-2-en-1-imine (PubChem CID 11401417) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is (E)-N-(1-phenylethyl)hex-2-en-1-imine.

Molecular Properties

Compound Name(E)-N-(1-phenylethyl)hex-2-en-1-imine
PubChem CID11401417
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name(E)-N-(1-phenylethyl)hex-2-en-1-imine
SMILESCCC/C=C/C=N/C(C)c1ccccc1
InChIInChI=1S/C14H19N/c1-3-4-5-9-12-15-13(2)14-10-7-6-8-11-14/h5-13H,3-4H2,1-2H3/b9-5+,15-12+
InChIKeyPFZHQCYZAPJSBT-KJCDSFJNSA-N
XLogP4.17
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-[(1R)-1-phenylethyl]-N'-[(1S)-1-phenylethyl]ethane-1,2-diimine
CID 148629310
[(Z)-1-phenyloct-4-enyl]benzene
CID 143321928
4-methyl-N-[(1S)-1-phenylethyl]octan-1-imine
CID 100967564
[(3E,5E)-nona-3,5-dien-2-yl]sulfonylbenzene
CID 13182054
2,2-dimethyl-N-(1-phenylethyl)propan-1-imine
CID 19708107
ethane;3-(1-phenylethylimino)propanethial
CID 90970387
3-phenyl-N-(1-phenylethyl)prop-2-yn-1-imine
CID 11736454
deca-2,4,6-trienoic acid;toluene
CID 86643557
2,2-dimethoxy-N-(1-phenylethyl)ethanimine
CID 11651382
ethyl-oxido-(1-phenylethylimino)azanium
CID 13172939
(4E,6E)-2-methyldeca-4,6-diene
CID 102247745
copper bis(1-[[(1R)-1-phenylethyl]iminomethyl]naphthalen-2-olate)
CID 139163460

Frequently Asked Questions

What is the IUPAC name of (E)-N-(1-phenylethyl)hex-2-en-1-imine?
The IUPAC name of (E)-N-(1-phenylethyl)hex-2-en-1-imine (CID 11401417) is (E)-N-(1-phenylethyl)hex-2-en-1-imine.
What is the SMILES notation for (E)-N-(1-phenylethyl)hex-2-en-1-imine?
The canonical SMILES for (E)-N-(1-phenylethyl)hex-2-en-1-imine is CCC/C=C/C=N/C(C)c1ccccc1.
What is the InChIKey of (E)-N-(1-phenylethyl)hex-2-en-1-imine?
The InChIKey is PFZHQCYZAPJSBT-KJCDSFJNSA-N. The full InChI is InChI=1S/C14H19N/c1-3-4-5-9-12-15-13(2)14-10-7-6-8-11-14/h5-13H,3-4H2,1-2H3/b9-5+,15-12+.
What are the key properties of (E)-N-(1-phenylethyl)hex-2-en-1-imine?
(E)-N-(1-phenylethyl)hex-2-en-1-imine has a molecular weight of 201.31 g/mol, XLogP of 4.17, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(1-phenylethyl)hex-2-en-1-imine is sourced from PubChem (CID 11401417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).