(E)-4-fluoro-N-methylbut-2-en-2-amine

C5H10FN — CID 129208250

IUPAC(E)-4-fluoro-N-methylbut-2-en-2-amine
SMILESCN/C(C)=C/CF
InChIInChI=1S/C5H10FN/c1-5(7-2)3-4-6/h3,7H,4H2,1-2H3/b5-3+
InChIKeyZRKRCQPHKTZDRB-HWKANZROSA-N
MW103.14 g/mol
LogP1.08
Rot. Bonds2

About (E)-4-fluoro-N-methylbut-2-en-2-amine

(E)-4-fluoro-N-methylbut-2-en-2-amine (PubChem CID 129208250) has the molecular formula C5H10FN and a molecular weight of 103.14 g/mol. Its IUPAC name is (E)-4-fluoro-N-methylbut-2-en-2-amine.

Molecular Properties

Compound Name(E)-4-fluoro-N-methylbut-2-en-2-amine
PubChem CID129208250
Molecular FormulaC5H10FN
Molecular Weight103.14 g/mol
Exact Mass103.08
IUPAC Name(E)-4-fluoro-N-methylbut-2-en-2-amine
SMILESCN/C(C)=C/CF
InChIInChI=1S/C5H10FN/c1-5(7-2)3-4-6/h3,7H,4H2,1-2H3/b5-3+
InChIKeyZRKRCQPHKTZDRB-HWKANZROSA-N
XLogP1.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.14
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-4-fluoro-N-methylbut-2-en-2-amine?
The IUPAC name of (E)-4-fluoro-N-methylbut-2-en-2-amine (CID 129208250) is (E)-4-fluoro-N-methylbut-2-en-2-amine.
What is the SMILES notation for (E)-4-fluoro-N-methylbut-2-en-2-amine?
The canonical SMILES for (E)-4-fluoro-N-methylbut-2-en-2-amine is CN/C(C)=C/CF.
What is the InChIKey of (E)-4-fluoro-N-methylbut-2-en-2-amine?
The InChIKey is ZRKRCQPHKTZDRB-HWKANZROSA-N. The full InChI is InChI=1S/C5H10FN/c1-5(7-2)3-4-6/h3,7H,4H2,1-2H3/b5-3+.
What are the key properties of (E)-4-fluoro-N-methylbut-2-en-2-amine?
(E)-4-fluoro-N-methylbut-2-en-2-amine has a molecular weight of 103.14 g/mol, XLogP of 1.08, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-fluoro-N-methylbut-2-en-2-amine is sourced from PubChem (CID 129208250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).