N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide

C5H10FN3 — CID 135244616

IUPACN'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide
SMILESCN/C=C(\F)C/N=C/N
InChIInChI=1S/C5H10FN3/c1-8-2-5(6)3-9-4-7/h2,4,8H,3H2,1H3,(H2,7,9)/b5-2-
InChIKeyKZDGQQSTJNKZMO-DJWKRKHSSA-N
MW131.15 g/mol
LogP0.00
Rot. Bonds3

About N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide

N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide (PubChem CID 135244616) has the molecular formula C5H10FN3 and a molecular weight of 131.15 g/mol. Its IUPAC name is N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide.

Molecular Properties

Compound NameN'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide
PubChem CID135244616
Molecular FormulaC5H10FN3
Molecular Weight131.15 g/mol
Exact Mass131.09
IUPAC NameN'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide
SMILESCN/C=C(\F)C/N=C/N
InChIInChI=1S/C5H10FN3/c1-8-2-5(6)3-9-4-7/h2,4,8H,3H2,1H3,(H2,7,9)/b5-2-
InChIKeyKZDGQQSTJNKZMO-DJWKRKHSSA-N
XLogP0.00
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.15
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide?
The IUPAC name of N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide (CID 135244616) is N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide.
What is the SMILES notation for N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide?
The canonical SMILES for N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide is CN/C=C(\F)C/N=C/N.
What is the InChIKey of N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide?
The InChIKey is KZDGQQSTJNKZMO-DJWKRKHSSA-N. The full InChI is InChI=1S/C5H10FN3/c1-8-2-5(6)3-9-4-7/h2,4,8H,3H2,1H3,(H2,7,9)/b5-2-.
What are the key properties of N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide?
N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide has a molecular weight of 131.15 g/mol, XLogP of 0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-2-fluoro-3-(methylamino)prop-2-enyl]methanimidamide is sourced from PubChem (CID 135244616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).