N'-ethenyl-N-methylidenecarbamimidoyl fluoride

C4H5FN2 — CID 171497193

IUPACN'-ethenyl-N-methylidenecarbamimidoyl fluoride
SMILESC=C/N=C(\F)N=C
InChIInChI=1S/C4H5FN2/c1-3-7-4(5)6-2/h3H,1-2H2/b7-4+
InChIKeyIPIZJCQYGBZSCG-QPJJXVBHSA-N
MW100.10 g/mol
LogP1.16
Rot. Bonds1

About N'-ethenyl-N-methylidenecarbamimidoyl fluoride

N'-ethenyl-N-methylidenecarbamimidoyl fluoride (PubChem CID 171497193) has the molecular formula C4H5FN2 and a molecular weight of 100.10 g/mol. Its IUPAC name is N'-ethenyl-N-methylidenecarbamimidoyl fluoride.

Molecular Properties

Compound NameN'-ethenyl-N-methylidenecarbamimidoyl fluoride
PubChem CID171497193
Molecular FormulaC4H5FN2
Molecular Weight100.10 g/mol
Exact Mass100.04
IUPAC NameN'-ethenyl-N-methylidenecarbamimidoyl fluoride
SMILESC=C/N=C(\F)N=C
InChIInChI=1S/C4H5FN2/c1-3-7-4(5)6-2/h3H,1-2H2/b7-4+
InChIKeyIPIZJCQYGBZSCG-QPJJXVBHSA-N
XLogP1.16
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.10
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

3,4,6-Triazaocta-1,3,5,7-tetraene
CID 89223796
1,3,5-Triazacyclohepta-1,3,4,6-tetraene
CID 91325987
N'-ethenyl-2,2,2-trifluoro-N-methylideneethanimidamide
CID 163299053
N,N'-bis(ethenyl)-N-fluoromethanimidamide
CID 167111285
N'-(1-fluoroethenyl)-N-methylidenecarbamimidoyl fluoride
CID 178805708
N'-ethenyl-N-methylidenemethanimidamide
CID 90903236
2-Ethenyl-1-methylideneguanidine
CID 91490843
N'-ethenyl-N-methylidenecarbamimidoyl chloride
CID 123893518
ethane;N'-ethenyl-N-methylidenemethanimidamide
CID 143822085
N'-ethenyl-N-methylidenecarbamimidoyl bromide
CID 144080315
N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide
CID 149183574
N,N'-bis(ethenyl)methanediimine
CID 153914174

Frequently Asked Questions

What is the IUPAC name of N'-ethenyl-N-methylidenecarbamimidoyl fluoride?
The IUPAC name of N'-ethenyl-N-methylidenecarbamimidoyl fluoride (CID 171497193) is N'-ethenyl-N-methylidenecarbamimidoyl fluoride.
What is the SMILES notation for N'-ethenyl-N-methylidenecarbamimidoyl fluoride?
The canonical SMILES for N'-ethenyl-N-methylidenecarbamimidoyl fluoride is C=C/N=C(\F)N=C.
What is the InChIKey of N'-ethenyl-N-methylidenecarbamimidoyl fluoride?
The InChIKey is IPIZJCQYGBZSCG-QPJJXVBHSA-N. The full InChI is InChI=1S/C4H5FN2/c1-3-7-4(5)6-2/h3H,1-2H2/b7-4+.
What are the key properties of N'-ethenyl-N-methylidenecarbamimidoyl fluoride?
N'-ethenyl-N-methylidenecarbamimidoyl fluoride has a molecular weight of 100.10 g/mol, XLogP of 1.16, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethenyl-N-methylidenecarbamimidoyl fluoride is sourced from PubChem (CID 171497193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).