2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide

C18H15F2NO2 — CID 91711960

IUPAC2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide
SMILESC=C(C)CN(C(=O)c1ccccc1F)C(=O)c1ccccc1F
InChIInChI=1S/C18H15F2NO2/c1-12(2)11-21(17(22)13-7-3-5-9-15(13)19)18(23)14-8-4-6-10-16(14)20/h3-10H,1,11H2,2H3
InChIKeyNNIQSLUENARPRS-UHFFFAOYSA-N
MW315.32 g/mol
LogP3.82
Rot. Bonds4

About 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide

2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide (PubChem CID 91711960) has the molecular formula C18H15F2NO2 and a molecular weight of 315.32 g/mol. Its IUPAC name is 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide
PubChem CID91711960
Molecular FormulaC18H15F2NO2
Molecular Weight315.32 g/mol
Exact Mass315.11
IUPAC Name2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide
SMILESC=C(C)CN(C(=O)c1ccccc1F)C(=O)c1ccccc1F
InChIInChI=1S/C18H15F2NO2/c1-12(2)11-21(17(22)13-7-3-5-9-15(13)19)18(23)14-8-4-6-10-16(14)20/h3-10H,1,11H2,2H3
InChIKeyNNIQSLUENARPRS-UHFFFAOYSA-N
XLogP3.82
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.32
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-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

N-(3-amino-3-oxoprop-1-en-2-yl)-N-ethyl-2-fluorobenzamide
CID 175462832
methyl 2-[(2-fluorobenzoyl)-(2-methoxy-2-oxoethyl)amino]acetate
CID 62953294
3-[carboxymethyl-(2-fluorobenzoyl)amino]propanoic acid
CID 82324752
2-fluoro-N-[2-(methylamino)-2-oxoethyl]-N-propylbenzamide
CID 61046623
2-[(2-fluorobenzoyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 78990578
N-benzyl-2-fluoro-N-[(E)-2-methyl-3-phenylprop-2-enyl]benzamide
CID 42697725
N-(3-aminopropyl)-2-fluoro-N-propylbenzamide
CID 43136602
1-(2-fluorophenyl)butane-1,3-dione
CID 15169784
2-fluoro-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzamide
CID 54915998
1-(3-fluoro-2-methylphenyl)-3-methylbut-3-en-1-one
CID 130901661
propyl 2-[(2-fluorobenzoyl)-methylamino]acetate
CID 91711904
ethane;2-fluorobenzoic acid
CID 91182768

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide?
The IUPAC name of 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide (CID 91711960) is 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide?
The canonical SMILES for 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide is C=C(C)CN(C(=O)c1ccccc1F)C(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide?
The InChIKey is NNIQSLUENARPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F2NO2/c1-12(2)11-21(17(22)13-7-3-5-9-15(13)19)18(23)14-8-4-6-10-16(14)20/h3-10H,1,11H2,2H3.
What are the key properties of 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide?
2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide has a molecular weight of 315.32 g/mol, XLogP of 3.82, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(2-fluorobenzoyl)-N-(2-methylprop-2-enyl)benzamide is sourced from PubChem (CID 91711960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).