(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide

C15H12FNO — CID 143788197

IUPAC(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide
SMILESNC(=O)/C(=C/c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C15H12FNO/c16-13-8-6-11(7-9-13)10-14(15(17)18)12-4-2-1-3-5-12/h1-10H,(H2,17,18)/b14-10+
InChIKeyHDRGOCNAVMKNQR-GXDHUFHOSA-N
MW241.26 g/mol
LogP2.85
Rot. Bonds3

About (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide

(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide (PubChem CID 143788197) has the molecular formula C15H12FNO and a molecular weight of 241.26 g/mol. Its IUPAC name is (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide
PubChem CID143788197
Molecular FormulaC15H12FNO
Molecular Weight241.26 g/mol
Exact Mass241.09
IUPAC Name(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide
SMILESNC(=O)/C(=C/c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C15H12FNO/c16-13-8-6-11(7-9-13)10-14(15(17)18)12-4-2-1-3-5-12/h1-10H,(H2,17,18)/b14-10+
InChIKeyHDRGOCNAVMKNQR-GXDHUFHOSA-N
XLogP2.85
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.26
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-2,3-diphenylprop-2-enamide
CID 6016357
(E)-3-(4-fluorophenyl)-1,2-diphenylprop-2-en-1-one
CID 5388476
(E)-2-(4-fluorophenyl)-3-(4-methoxyphenyl)prop-2-enamide
CID 143788230
N-(2-aminophenyl)-4-methylbenzamide;(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide
CID 143788196
N-[(Z)-3-amino-1-(4-fluorophenyl)-3-oxoprop-1-en-2-yl]benzamide
CID 7380729
2-(1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)prop-2-enamide
CID 2753743
2-phenyl-3-pyrimidin-2-ylprop-2-enamide
CID 138629332
benzoic acid;4-fluorobenzaldehyde
CID 159074063
(E)-2-(3-cyanophenyl)-3-phenylprop-2-enamide
CID 124561936
(E)-2,3-bis(4-methoxyphenyl)prop-2-enamide
CID 11358044
2-benzamido-3-(4-fluorophenyl)prop-2-enoic acid
CID 761263
(Z)-3-(2-aminophenyl)-2-(4-fluorophenyl)prop-2-enoic acid
CID 5376034

Frequently Asked Questions

What is the IUPAC name of (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide?
The IUPAC name of (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide (CID 143788197) is (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide.
What is the SMILES notation for (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide?
The canonical SMILES for (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide is NC(=O)/C(=C/c1ccc(F)cc1)c1ccccc1.
What is the InChIKey of (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide?
The InChIKey is HDRGOCNAVMKNQR-GXDHUFHOSA-N. The full InChI is InChI=1S/C15H12FNO/c16-13-8-6-11(7-9-13)10-14(15(17)18)12-4-2-1-3-5-12/h1-10H,(H2,17,18)/b14-10+.
What are the key properties of (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide?
(E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide has a molecular weight of 241.26 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(4-fluorophenyl)-2-phenylprop-2-enamide is sourced from PubChem (CID 143788197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).