N'-amino-2-fluoroethanimidamide

C2H6FN3 — CID 6004184

IUPACN'-amino-2-fluoroethanimidamide
SMILESN/N=C(/N)CF
InChIInChI=1S/C2H6FN3/c3-1-2(4)6-5/h1,5H2,(H2,4,6)
InChIKeyQDBZXZAWWAWVGC-UHFFFAOYSA-N
MW91.09 g/mol
LogP-0.81
Rot. Bonds1

About N'-amino-2-fluoroethanimidamide

N'-amino-2-fluoroethanimidamide (PubChem CID 6004184) has the molecular formula C2H6FN3 and a molecular weight of 91.09 g/mol. Its IUPAC name is N'-amino-2-fluoroethanimidamide.

Molecular Properties

Compound NameN'-amino-2-fluoroethanimidamide
PubChem CID6004184
Molecular FormulaC2H6FN3
Molecular Weight91.09 g/mol
Exact Mass91.05
IUPAC NameN'-amino-2-fluoroethanimidamide
SMILESN/N=C(/N)CF
InChIInChI=1S/C2H6FN3/c3-1-2(4)6-5/h1,5H2,(H2,4,6)
InChIKeyQDBZXZAWWAWVGC-UHFFFAOYSA-N
XLogP-0.81
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50091.09
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-amino-2-fluoroethanimidamide?
The IUPAC name of N'-amino-2-fluoroethanimidamide (CID 6004184) is N'-amino-2-fluoroethanimidamide.
What is the SMILES notation for N'-amino-2-fluoroethanimidamide?
The canonical SMILES for N'-amino-2-fluoroethanimidamide is N/N=C(/N)CF.
What is the InChIKey of N'-amino-2-fluoroethanimidamide?
The InChIKey is QDBZXZAWWAWVGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6FN3/c3-1-2(4)6-5/h1,5H2,(H2,4,6).
What are the key properties of N'-amino-2-fluoroethanimidamide?
N'-amino-2-fluoroethanimidamide has a molecular weight of 91.09 g/mol, XLogP of -0.81, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-2-fluoroethanimidamide is sourced from PubChem (CID 6004184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).