N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide

C19H20FNO — CID 59811460

IUPACN-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide
SMILESCCC/C=C/c1ccc(C(=O)NCc2cccc(F)c2)cc1
InChIInChI=1S/C19H20FNO/c1-2-3-4-6-15-9-11-17(12-10-15)19(22)21-14-16-7-5-8-18(20)13-16/h4-13H,2-3,14H2,1H3,(H,21,22)/b6-4+
InChIKeyAEXMYESYAYSNJY-GQCTYLIASA-N
MW297.37 g/mol
LogP4.57
Rot. Bonds6

About N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide

N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide (PubChem CID 59811460) has the molecular formula C19H20FNO and a molecular weight of 297.37 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide
PubChem CID59811460
Molecular FormulaC19H20FNO
Molecular Weight297.37 g/mol
Exact Mass297.15
IUPAC NameN-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide
SMILESCCC/C=C/c1ccc(C(=O)NCc2cccc(F)c2)cc1
InChIInChI=1S/C19H20FNO/c1-2-3-4-6-15-9-11-17(12-10-15)19(22)21-14-16-7-5-8-18(20)13-16/h4-13H,2-3,14H2,1H3,(H,21,22)/b6-4+
InChIKeyAEXMYESYAYSNJY-GQCTYLIASA-N
XLogP4.57
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(E)-3,3-dimethylbut-1-enyl]-N-[(3-fluorophenyl)methyl]benzamide
CID 59811458
N-[(3-fluorophenyl)methyl]-4-(propylamino)benzamide
CID 62165093
4-(ethylamino)-N-[(3-fluorophenyl)methyl]benzamide
CID 62165092
N-[(3-fluorophenyl)methyl]-4-[4-(hydroxycarbamoyl)phenyl]benzamide
CID 87468494
N-[(3-fluorophenyl)methyl]-4-sulfanylbenzamide
CID 107022080
4-amino-N-[(3-fluorophenyl)methyl]-3-methylbenzamide
CID 28970018
4-[ethyl(methylsulfonyl)amino]-N-[(3-fluorophenyl)methyl]benzamide
CID 53282813
3-bromo-4-fluoro-N-[(3-fluorophenyl)methyl]benzamide
CID 113244666
N-[(3,5-difluorophenyl)methyl]-4-ethylbenzamide
CID 71822308
N-[(3-fluorophenyl)methyl]-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103997880
4-bromo-N-[(3-fluorophenyl)methyl]-3-hydroxybenzamide
CID 103830502
N-benzyl-4-(3,3-dimethylbut-1-enyl)benzamide
CID 85424416

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide (CID 59811460) is N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide is CCC/C=C/c1ccc(C(=O)NCc2cccc(F)c2)cc1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide?
The InChIKey is AEXMYESYAYSNJY-GQCTYLIASA-N. The full InChI is InChI=1S/C19H20FNO/c1-2-3-4-6-15-9-11-17(12-10-15)19(22)21-14-16-7-5-8-18(20)13-16/h4-13H,2-3,14H2,1H3,(H,21,22)/b6-4+.
What are the key properties of N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide?
N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide has a molecular weight of 297.37 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-4-[(E)-pent-1-enyl]benzamide is sourced from PubChem (CID 59811460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).