2-fluoro-N-phenyl-N-prop-2-enylbenzamide

C16H14FNO — CID 78795026

IUPAC2-fluoro-N-phenyl-N-prop-2-enylbenzamide
SMILESC=CCN(C(=O)c1ccccc1F)c1ccccc1
InChIInChI=1S/C16H14FNO/c1-2-12-18(13-8-4-3-5-9-13)16(19)14-10-6-7-11-15(14)17/h2-11H,1,12H2
InChIKeyZTSKXDNOILFUNM-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.66
Rot. Bonds4

About 2-fluoro-N-phenyl-N-prop-2-enylbenzamide

2-fluoro-N-phenyl-N-prop-2-enylbenzamide (PubChem CID 78795026) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is 2-fluoro-N-phenyl-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name2-fluoro-N-phenyl-N-prop-2-enylbenzamide
PubChem CID78795026
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name2-fluoro-N-phenyl-N-prop-2-enylbenzamide
SMILESC=CCN(C(=O)c1ccccc1F)c1ccccc1
InChIInChI=1S/C16H14FNO/c1-2-12-18(13-8-4-3-5-9-13)16(19)14-10-6-7-11-15(14)17/h2-11H,1,12H2
InChIKeyZTSKXDNOILFUNM-UHFFFAOYSA-N
XLogP3.66
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(cyanomethyl)-2-fluoro-N-phenylbenzamide
CID 82131953
2-nitro-N-phenyl-N-prop-2-enylbenzamide
CID 11482940
2-chloro-5-methylsulfanyl-N-phenyl-N-prop-2-enylbenzamide
CID 38113942
N-[(1-benzylpyrrol-2-yl)methyl]-2-fluoro-N-prop-2-enylbenzamide
CID 810272
1-(2-fluorophenyl)-6-oxo-N-phenyl-N-prop-2-enylpyridazine-3-carboxamide
CID 122133066
2,3,3,3-tetrafluoro-2-methyl-N-phenyl-N-prop-2-enylpropanamide
CID 118052424
2,2,2-trichloro-N-phenyl-N-prop-2-enylacetamide
CID 10901943
N-(2-aminoethyl)-2-fluoro-N-(4-fluorophenyl)benzamide
CID 28769276
3-methyl-N-phenyl-N-prop-2-enylbenzamide
CID 78794859
N-phenyl-N-prop-2-enylcyclopropanecarboxamide
CID 78836355
2-[[2-[(2-fluorobenzoyl)amino]acetyl]-prop-2-enylamino]acetic acid
CID 79265565
2-fluoro-N-prop-2-enylbenzamide
CID 4125319

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-phenyl-N-prop-2-enylbenzamide?
The IUPAC name of 2-fluoro-N-phenyl-N-prop-2-enylbenzamide (CID 78795026) is 2-fluoro-N-phenyl-N-prop-2-enylbenzamide.
What is the SMILES notation for 2-fluoro-N-phenyl-N-prop-2-enylbenzamide?
The canonical SMILES for 2-fluoro-N-phenyl-N-prop-2-enylbenzamide is C=CCN(C(=O)c1ccccc1F)c1ccccc1.
What is the InChIKey of 2-fluoro-N-phenyl-N-prop-2-enylbenzamide?
The InChIKey is ZTSKXDNOILFUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-2-12-18(13-8-4-3-5-9-13)16(19)14-10-6-7-11-15(14)17/h2-11H,1,12H2.
What are the key properties of 2-fluoro-N-phenyl-N-prop-2-enylbenzamide?
2-fluoro-N-phenyl-N-prop-2-enylbenzamide has a molecular weight of 255.29 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-phenyl-N-prop-2-enylbenzamide is sourced from PubChem (CID 78795026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).