(Z)-N-ethyl-2-phenylpent-2-en-1-imine

C13H17N — CID 143898078

IUPAC(Z)-N-ethyl-2-phenylpent-2-en-1-imine
SMILESCC/C=C(\C=N\CC)c1ccccc1
InChIInChI=1S/C13H17N/c1-3-8-13(11-14-4-2)12-9-6-5-7-10-12/h5-11H,3-4H2,1-2H3/b13-8+,14-11+
InChIKeyZSMZZFZMNQSLPM-HVUCGZAQSA-N
MW187.29 g/mol
LogP3.57
Rot. Bonds4

About (Z)-N-ethyl-2-phenylpent-2-en-1-imine

(Z)-N-ethyl-2-phenylpent-2-en-1-imine (PubChem CID 143898078) has the molecular formula C13H17N and a molecular weight of 187.29 g/mol. Its IUPAC name is (Z)-N-ethyl-2-phenylpent-2-en-1-imine.

Molecular Properties

Compound Name(Z)-N-ethyl-2-phenylpent-2-en-1-imine
PubChem CID143898078
Molecular FormulaC13H17N
Molecular Weight187.29 g/mol
Exact Mass187.14
IUPAC Name(Z)-N-ethyl-2-phenylpent-2-en-1-imine
SMILESCC/C=C(\C=N\CC)c1ccccc1
InChIInChI=1S/C13H17N/c1-3-8-13(11-14-4-2)12-9-6-5-7-10-12/h5-11H,3-4H2,1-2H3/b13-8+,14-11+
InChIKeyZSMZZFZMNQSLPM-HVUCGZAQSA-N
XLogP3.57
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 53.57
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

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CID 175706881
1-bromobut-1-enylbenzene
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CID 102093677
4-ethylimino-1,1,1-trifluoro-3-phenylbut-2-en-2-amine
CID 174037599
(Z)-2-methylidene-3-phenylhex-3-enenitrile
CID 167310558
1-methoxybut-1-enylbenzene
CID 69305429
N,N-dimethyl-1-phenylbut-1-en-1-amine
CID 154209474
2-hydroxy-1-phenylpent-2-en-1-one
CID 154192343
N'-[(Z)-1-phenylbut-1-enyl]benzenecarboximidamide
CID 145334764
3-phenylhex-3-en-2-one
CID 130637770
hex-3-en-1-yn-3-ylbenzene
CID 144766057
2-methyl-1-phenylpent-2-en-1-one
CID 130638834

Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-2-phenylpent-2-en-1-imine?
The IUPAC name of (Z)-N-ethyl-2-phenylpent-2-en-1-imine (CID 143898078) is (Z)-N-ethyl-2-phenylpent-2-en-1-imine.
What is the SMILES notation for (Z)-N-ethyl-2-phenylpent-2-en-1-imine?
The canonical SMILES for (Z)-N-ethyl-2-phenylpent-2-en-1-imine is CC/C=C(\C=N\CC)c1ccccc1.
What is the InChIKey of (Z)-N-ethyl-2-phenylpent-2-en-1-imine?
The InChIKey is ZSMZZFZMNQSLPM-HVUCGZAQSA-N. The full InChI is InChI=1S/C13H17N/c1-3-8-13(11-14-4-2)12-9-6-5-7-10-12/h5-11H,3-4H2,1-2H3/b13-8+,14-11+.
What are the key properties of (Z)-N-ethyl-2-phenylpent-2-en-1-imine?
(Z)-N-ethyl-2-phenylpent-2-en-1-imine has a molecular weight of 187.29 g/mol, XLogP of 3.57, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-2-phenylpent-2-en-1-imine is sourced from PubChem (CID 143898078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).