1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine

C5H7FN2 — CID 156652984

IUPAC1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine
SMILESC=C(F)/C=N\C(=C)N
InChIInChI=1S/C5H7FN2/c1-4(6)3-8-5(2)7/h3H,1-2,7H2/b8-3-
InChIKeyKYUAVYJYPOZTTH-BAQGIRSFSA-N
MW114.12 g/mol
LogP0.97
Rot. Bonds2

About 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine

1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine (PubChem CID 156652984) has the molecular formula C5H7FN2 and a molecular weight of 114.12 g/mol. Its IUPAC name is 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine.

Molecular Properties

Compound Name1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine
PubChem CID156652984
Molecular FormulaC5H7FN2
Molecular Weight114.12 g/mol
Exact Mass114.06
IUPAC Name1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine
SMILESC=C(F)/C=N\C(=C)N
InChIInChI=1S/C5H7FN2/c1-4(6)3-8-5(2)7/h3H,1-2,7H2/b8-3-
InChIKeyKYUAVYJYPOZTTH-BAQGIRSFSA-N
XLogP0.97
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.12
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-fluoro-3-methyliminoprop-1-en-1-amine
CID 87688897
N'-ethylidene-2-fluoroprop-2-ene-1,3-diimine
CID 123586364
(E)-2-fluoro-N'-methylideneprop-2-ene-1,3-diimine
CID 126747074
(E)-3-ethenylimino-2-fluoroprop-1-en-1-amine
CID 146594000
2-Fluoro-3-methyliminoprop-1-en-1-amine
CID 147359228
(Z)-2-(2-fluoroprop-2-enylideneamino)ethenamine
CID 163721266
N-[(Z)-3-iminoprop-1-enyl]methanimidoyl fluoride
CID 169963153
N-(2-fluoroprop-2-enylidene)methanimidamide
CID 145177090

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine?
The IUPAC name of 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine (CID 156652984) is 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine.
What is the SMILES notation for 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine?
The canonical SMILES for 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine is C=C(F)/C=N\C(=C)N.
What is the InChIKey of 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine?
The InChIKey is KYUAVYJYPOZTTH-BAQGIRSFSA-N. The full InChI is InChI=1S/C5H7FN2/c1-4(6)3-8-5(2)7/h3H,1-2,7H2/b8-3-.
What are the key properties of 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine?
1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine has a molecular weight of 114.12 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-2-fluoroprop-2-enylideneamino]ethenamine is sourced from PubChem (CID 156652984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).