(E)-4-(4-fluorophenyl)but-3-enamide

C10H10FNO — CID 101344371

IUPAC(E)-4-(4-fluorophenyl)but-3-enamide
SMILESNC(=O)C/C=C/c1ccc(F)cc1
InChIInChI=1S/C10H10FNO/c11-9-6-4-8(5-7-9)2-1-3-10(12)13/h1-2,4-7H,3H2,(H2,12,13)/b2-1+
InChIKeyDRDFXLBGBCYYQU-OWOJBTEDSA-N
MW179.19 g/mol
LogP1.71
Rot. Bonds3

About (E)-4-(4-fluorophenyl)but-3-enamide

(E)-4-(4-fluorophenyl)but-3-enamide (PubChem CID 101344371) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is (E)-4-(4-fluorophenyl)but-3-enamide.

Molecular Properties

Compound Name(E)-4-(4-fluorophenyl)but-3-enamide
PubChem CID101344371
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name(E)-4-(4-fluorophenyl)but-3-enamide
SMILESNC(=O)C/C=C/c1ccc(F)cc1
InChIInChI=1S/C10H10FNO/c11-9-6-4-8(5-7-9)2-1-3-10(12)13/h1-2,4-7H,3H2,(H2,12,13)/b2-1+
InChIKeyDRDFXLBGBCYYQU-OWOJBTEDSA-N
XLogP1.71
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-hydrazinylphenyl)but-3-enamide
CID 170797562
4-(4-tert-butylphenyl)but-3-enamide
CID 170798132
4-[4-(hydrazinecarbonyl)phenyl]but-3-enamide
CID 170798274
4-(4-propan-2-ylphenyl)but-3-enamide
CID 170797717
4-(4-prop-1-en-2-ylphenyl)but-3-enamide
CID 170797716
2-[5-(4-amino-4-oxobut-1-enyl)-2-fluorophenyl]acetic acid
CID 170798417
4-[3-fluoro-4-(trifluoromethyl)phenyl]but-3-enamide
CID 170798409
4-[4-(2-cyanoacetyl)phenyl]but-3-enamide
CID 170798579
4-[3-fluoro-5-(hydroxymethyl)phenyl]but-3-enamide
CID 170797801
4-(5-fluoro-2-methylphenyl)but-3-enamide
CID 170797411
4-(4-piperazin-1-ylphenyl)but-3-enamide
CID 170798696
4-[4-(1,2-oxazol-5-yl)phenyl]but-3-enamide
CID 170798671

Frequently Asked Questions

What is the IUPAC name of (E)-4-(4-fluorophenyl)but-3-enamide?
The IUPAC name of (E)-4-(4-fluorophenyl)but-3-enamide (CID 101344371) is (E)-4-(4-fluorophenyl)but-3-enamide.
What is the SMILES notation for (E)-4-(4-fluorophenyl)but-3-enamide?
The canonical SMILES for (E)-4-(4-fluorophenyl)but-3-enamide is NC(=O)C/C=C/c1ccc(F)cc1.
What is the InChIKey of (E)-4-(4-fluorophenyl)but-3-enamide?
The InChIKey is DRDFXLBGBCYYQU-OWOJBTEDSA-N. The full InChI is InChI=1S/C10H10FNO/c11-9-6-4-8(5-7-9)2-1-3-10(12)13/h1-2,4-7H,3H2,(H2,12,13)/b2-1+.
What are the key properties of (E)-4-(4-fluorophenyl)but-3-enamide?
(E)-4-(4-fluorophenyl)but-3-enamide has a molecular weight of 179.19 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-(4-fluorophenyl)but-3-enamide is sourced from PubChem (CID 101344371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).