N'-ethenyl-N-fluoro-N-methylmethanimidamide

C4H7FN2 — CID 146433706

IUPACN'-ethenyl-N-fluoro-N-methylmethanimidamide
SMILESC=C/N=C/N(C)F
InChIInChI=1S/C4H7FN2/c1-3-6-4-7(2)5/h3-4H,1H2,2H3/b6-4+
InChIKeyIECUVZWCWHLKAF-GQCTYLIASA-N
MW102.11 g/mol
LogP0.97
Rot. Bonds2

About N'-ethenyl-N-fluoro-N-methylmethanimidamide

N'-ethenyl-N-fluoro-N-methylmethanimidamide (PubChem CID 146433706) has the molecular formula C4H7FN2 and a molecular weight of 102.11 g/mol. Its IUPAC name is N'-ethenyl-N-fluoro-N-methylmethanimidamide.

Molecular Properties

Compound NameN'-ethenyl-N-fluoro-N-methylmethanimidamide
PubChem CID146433706
Molecular FormulaC4H7FN2
Molecular Weight102.11 g/mol
Exact Mass102.06
IUPAC NameN'-ethenyl-N-fluoro-N-methylmethanimidamide
SMILESC=C/N=C/N(C)F
InChIInChI=1S/C4H7FN2/c1-3-6-4-7(2)5/h3-4H,1H2,2H3/b6-4+
InChIKeyIECUVZWCWHLKAF-GQCTYLIASA-N
XLogP0.97
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.11
LogP ≤ 50.97
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-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-ethenyl-N-fluoro-N-methylmethanimidamide?
The IUPAC name of N'-ethenyl-N-fluoro-N-methylmethanimidamide (CID 146433706) is N'-ethenyl-N-fluoro-N-methylmethanimidamide.
What is the SMILES notation for N'-ethenyl-N-fluoro-N-methylmethanimidamide?
The canonical SMILES for N'-ethenyl-N-fluoro-N-methylmethanimidamide is C=C/N=C/N(C)F.
What is the InChIKey of N'-ethenyl-N-fluoro-N-methylmethanimidamide?
The InChIKey is IECUVZWCWHLKAF-GQCTYLIASA-N. The full InChI is InChI=1S/C4H7FN2/c1-3-6-4-7(2)5/h3-4H,1H2,2H3/b6-4+.
What are the key properties of N'-ethenyl-N-fluoro-N-methylmethanimidamide?
N'-ethenyl-N-fluoro-N-methylmethanimidamide has a molecular weight of 102.11 g/mol, XLogP of 0.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethenyl-N-fluoro-N-methylmethanimidamide is sourced from PubChem (CID 146433706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).