(E)-3-fluoro-N-propylprop-2-enamide

C6H10FNO — CID 134276339

IUPAC(E)-3-fluoro-N-propylprop-2-enamide
SMILESCCCNC(=O)/C=C/F
InChIInChI=1S/C6H10FNO/c1-2-5-8-6(9)3-4-7/h3-4H,2,5H2,1H3,(H,8,9)/b4-3+
InChIKeyQZKFHCNEYYAGMV-ONEGZZNKSA-N
MW131.15 g/mol
LogP1.00
Rot. Bonds3

About (E)-3-fluoro-N-propylprop-2-enamide

(E)-3-fluoro-N-propylprop-2-enamide (PubChem CID 134276339) has the molecular formula C6H10FNO and a molecular weight of 131.15 g/mol. Its IUPAC name is (E)-3-fluoro-N-propylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-fluoro-N-propylprop-2-enamide
PubChem CID134276339
Molecular FormulaC6H10FNO
Molecular Weight131.15 g/mol
Exact Mass131.07
IUPAC Name(E)-3-fluoro-N-propylprop-2-enamide
SMILESCCCNC(=O)/C=C/F
InChIInChI=1S/C6H10FNO/c1-2-5-8-6(9)3-4-7/h3-4H,2,5H2,1H3,(H,8,9)/b4-3+
InChIKeyQZKFHCNEYYAGMV-ONEGZZNKSA-N
XLogP1.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.15
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-3-fluoro-N-propylprop-2-enamide?
The IUPAC name of (E)-3-fluoro-N-propylprop-2-enamide (CID 134276339) is (E)-3-fluoro-N-propylprop-2-enamide.
What is the SMILES notation for (E)-3-fluoro-N-propylprop-2-enamide?
The canonical SMILES for (E)-3-fluoro-N-propylprop-2-enamide is CCCNC(=O)/C=C/F.
What is the InChIKey of (E)-3-fluoro-N-propylprop-2-enamide?
The InChIKey is QZKFHCNEYYAGMV-ONEGZZNKSA-N. The full InChI is InChI=1S/C6H10FNO/c1-2-5-8-6(9)3-4-7/h3-4H,2,5H2,1H3,(H,8,9)/b4-3+.
What are the key properties of (E)-3-fluoro-N-propylprop-2-enamide?
(E)-3-fluoro-N-propylprop-2-enamide has a molecular weight of 131.15 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluoro-N-propylprop-2-enamide is sourced from PubChem (CID 134276339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).