ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride

C8H14FN — CID 142896115

IUPACethane;(Z)-N-ethenylbut-2-enimidoyl fluoride
SMILESC=C/N=C(F)/C=C\C.CC
InChIInChI=1S/C6H8FN.C2H6/c1-3-5-6(7)8-4-2;1-2/h3-5H,2H2,1H3;1-2H3/b5-3-,8-6-;
InChIKeyYAWPJEMFUSMTFO-RBEAGIJSSA-N
MW143.20 g/mol
LogP3.10
Rot. Bonds2

About ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride

ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride (PubChem CID 142896115) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride.

Molecular Properties

Compound Nameethane;(Z)-N-ethenylbut-2-enimidoyl fluoride
PubChem CID142896115
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Nameethane;(Z)-N-ethenylbut-2-enimidoyl fluoride
SMILESC=C/N=C(F)/C=C\C.CC
InChIInChI=1S/C6H8FN.C2H6/c1-3-5-6(7)8-4-2;1-2/h3-5H,2H2,1H3;1-2H3/b5-3-,8-6-;
InChIKeyYAWPJEMFUSMTFO-RBEAGIJSSA-N
XLogP3.10
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 53.10
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-buta-1,2-dienylprop-2-enimidoyl fluoride
CID 123474203
(Z)-N-[(E)-3,3,3-trifluoroprop-1-enyl]but-2-enimidoyl fluoride
CID 123796974
N-[(Z)-prop-1-enyl]ethanimidoyl fluoride
CID 129055348
(2Z)-N-ethenylpenta-2,4-dienimidoyl fluoride
CID 130206759
N-[(1Z)-buta-1,3-dienyl]prop-2-enimidoyl fluoride
CID 132011259
4-fluoro-N-[(Z)-prop-1-enyl]pent-2-enimidoyl fluoride
CID 134172148
(Z)-N-ethylbut-2-enimidoyl fluoride
CID 134492872
(Z)-N-ethenylbut-2-enimidoyl fluoride
CID 142896116
N-[(Z)-prop-1-enyl]prop-2-enimidoyl fluoride
CID 143915091
(E)-N-ethenyl-2-fluorobut-2-en-1-imine
CID 145541980
N-[(1Z)-buta-1,3-dienyl]ethanimidoyl fluoride
CID 156479491
(Z,Z)-N-[(E)-1-fluorobut-1-enyl]but-2-en-1-imine
CID 167515069

Frequently Asked Questions

What is the IUPAC name of ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride?
The IUPAC name of ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride (CID 142896115) is ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride.
What is the SMILES notation for ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride?
The canonical SMILES for ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride is C=C/N=C(F)/C=C\C.CC.
What is the InChIKey of ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride?
The InChIKey is YAWPJEMFUSMTFO-RBEAGIJSSA-N. The full InChI is InChI=1S/C6H8FN.C2H6/c1-3-5-6(7)8-4-2;1-2/h3-5H,2H2,1H3;1-2H3/b5-3-,8-6-;.
What are the key properties of ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride?
ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride has a molecular weight of 143.20 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(Z)-N-ethenylbut-2-enimidoyl fluoride is sourced from PubChem (CID 142896115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).