(Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide

C15H12FNO — CID 170876937

IUPAC(Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide
SMILESNC(=O)/C=C\c1ccc(-c2cccc(F)c2)cc1
InChIInChI=1S/C15H12FNO/c16-14-3-1-2-13(10-14)12-7-4-11(5-8-12)6-9-15(17)18/h1-10H,(H2,17,18)/b9-6-
InChIKeyQPDDWWQFVOPGKP-TWGQIWQCSA-N
MW241.26 g/mol
LogP2.99
Rot. Bonds3

About (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide

(Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide (PubChem CID 170876937) has the molecular formula C15H12FNO and a molecular weight of 241.26 g/mol. Its IUPAC name is (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide.

Molecular Properties

Compound Name(Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide
PubChem CID170876937
Molecular FormulaC15H12FNO
Molecular Weight241.26 g/mol
Exact Mass241.09
IUPAC Name(Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide
SMILESNC(=O)/C=C\c1ccc(-c2cccc(F)c2)cc1
InChIInChI=1S/C15H12FNO/c16-14-3-1-2-13(10-14)12-7-4-11(5-8-12)6-9-15(17)18/h1-10H,(H2,17,18)/b9-6-
InChIKeyQPDDWWQFVOPGKP-TWGQIWQCSA-N
XLogP2.99
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 ≤ 52.99
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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Related Compounds

(Z)-3-[3-(3-fluorophenyl)phenyl]prop-2-enamide
CID 170876888
3-[4-(3-amino-3-oxoprop-1-enyl)phenyl]prop-2-enamide
CID 2749161
(Z)-3-[4-(3,4-dichlorophenyl)phenyl]prop-2-enamide
CID 170876865
(Z)-3-[3-(4-acetylphenyl)phenyl]prop-2-enamide
CID 170877551
(E)-3-[4-[(3-fluorophenyl)methoxy]phenyl]prop-2-enamide
CID 22476623
3-[4-(2-fluorophenyl)phenyl]prop-2-enamide
CID 165348625
(E)-3-[2-(3-fluorophenyl)-4-methylphenyl]prop-2-enamide
CID 170399726
2-[4-(3-fluorophenyl)phenyl]acetamide
CID 143262038
(E)-3-[4-[4-(hydroxymethyl)phenyl]phenyl]prop-2-enamide
CID 89009479
propan-2-yl 4-[3-[(Z)-3-amino-3-oxoprop-1-enyl]phenyl]benzoate
CID 170877625
2-fluoro-5-(3-fluorophenyl)benzamide
CID 46312277
(E)-3-[4-(3-amino-3-oxoprop-1-enyl)phenyl]prop-2-enoic acid
CID 169482234

Frequently Asked Questions

What is the IUPAC name of (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide?
The IUPAC name of (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide (CID 170876937) is (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide.
What is the SMILES notation for (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide?
The canonical SMILES for (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide is NC(=O)/C=C\c1ccc(-c2cccc(F)c2)cc1.
What is the InChIKey of (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide?
The InChIKey is QPDDWWQFVOPGKP-TWGQIWQCSA-N. The full InChI is InChI=1S/C15H12FNO/c16-14-3-1-2-13(10-14)12-7-4-11(5-8-12)6-9-15(17)18/h1-10H,(H2,17,18)/b9-6-.
What are the key properties of (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide?
(Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide has a molecular weight of 241.26 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-[4-(3-fluorophenyl)phenyl]prop-2-enamide is sourced from PubChem (CID 170876937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).