(Z)-N-ethylbut-2-enimidoyl fluoride

C6H10FN — CID 134492872

IUPAC(Z)-N-ethylbut-2-enimidoyl fluoride
SMILESC/C=C\C(F)=N\CC
InChIInChI=1S/C6H10FN/c1-3-5-6(7)8-4-2/h3,5H,4H2,1-2H3/b5-3-,8-6-
InChIKeyDNNBRPXBEQQFNB-NIOMPZRHSA-N
MW115.15 g/mol
LogP1.95
Rot. Bonds2

About (Z)-N-ethylbut-2-enimidoyl fluoride

(Z)-N-ethylbut-2-enimidoyl fluoride (PubChem CID 134492872) has the molecular formula C6H10FN and a molecular weight of 115.15 g/mol. Its IUPAC name is (Z)-N-ethylbut-2-enimidoyl fluoride.

Molecular Properties

Compound Name(Z)-N-ethylbut-2-enimidoyl fluoride
PubChem CID134492872
Molecular FormulaC6H10FN
Molecular Weight115.15 g/mol
Exact Mass115.08
IUPAC Name(Z)-N-ethylbut-2-enimidoyl fluoride
SMILESC/C=C\C(F)=N\CC
InChIInChI=1S/C6H10FN/c1-3-5-6(7)8-4-2/h3,5H,4H2,1-2H3/b5-3-,8-6-
InChIKeyDNNBRPXBEQQFNB-NIOMPZRHSA-N
XLogP1.95
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.15
LogP ≤ 51.95
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

(E)-5-Azahepta-2,4-diene
CID 5463161
(E)-2-fluoro-N-methylbut-2-en-1-imine
CID 91188405
(E)-2-fluoro-N-propylbut-2-en-1-imine
CID 123142232
3-fluoro-N-methylprop-2-en-1-imine
CID 123404468
N-buta-1,2-dienylprop-2-enimidoyl fluoride
CID 123474203
2-fluoro-N-methylbut-2-en-1-imine
CID 123705296
N-methylbut-2-enimidoyl fluoride
CID 123871369
N-butyl-3-fluoroprop-2-en-1-imine
CID 124032368
(Z)-4-fluoro-N-methylbut-2-enimidoyl fluoride
CID 139386565
(2Z)-N-methylpenta-2,4-dienimidoyl fluoride
CID 139386586
(E)-N-ethyl-2-fluorobut-2-en-1-imine
CID 141831603
N-[(E)-3-fluorobut-2-en-2-yl]prop-2-en-1-imine
CID 141985990

Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethylbut-2-enimidoyl fluoride?
The IUPAC name of (Z)-N-ethylbut-2-enimidoyl fluoride (CID 134492872) is (Z)-N-ethylbut-2-enimidoyl fluoride.
What is the SMILES notation for (Z)-N-ethylbut-2-enimidoyl fluoride?
The canonical SMILES for (Z)-N-ethylbut-2-enimidoyl fluoride is C/C=C\C(F)=N\CC.
What is the InChIKey of (Z)-N-ethylbut-2-enimidoyl fluoride?
The InChIKey is DNNBRPXBEQQFNB-NIOMPZRHSA-N. The full InChI is InChI=1S/C6H10FN/c1-3-5-6(7)8-4-2/h3,5H,4H2,1-2H3/b5-3-,8-6-.
What are the key properties of (Z)-N-ethylbut-2-enimidoyl fluoride?
(Z)-N-ethylbut-2-enimidoyl fluoride has a molecular weight of 115.15 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethylbut-2-enimidoyl fluoride is sourced from PubChem (CID 134492872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).