2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide

C15H13ClFNO — CID 26697286

IUPAC2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide
SMILESCCc1ccc(NC(=O)c2ccc(F)cc2Cl)cc1
InChIInChI=1S/C15H13ClFNO/c1-2-10-3-6-12(7-4-10)18-15(19)13-8-5-11(17)9-14(13)16/h3-9H,2H2,1H3,(H,18,19)
InChIKeyYMNJZXHJQVRPHD-UHFFFAOYSA-N
MW277.73 g/mol
LogP4.29
Rot. Bonds3

About 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide

2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide (PubChem CID 26697286) has the molecular formula C15H13ClFNO and a molecular weight of 277.73 g/mol. Its IUPAC name is 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide.

Molecular Properties

Compound Name2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide
PubChem CID26697286
Molecular FormulaC15H13ClFNO
Molecular Weight277.73 g/mol
Exact Mass277.07
IUPAC Name2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide
SMILESCCc1ccc(NC(=O)c2ccc(F)cc2Cl)cc1
InChIInChI=1S/C15H13ClFNO/c1-2-10-3-6-12(7-4-10)18-15(19)13-8-5-11(17)9-14(13)16/h3-9H,2H2,1H3,(H,18,19)
InChIKeyYMNJZXHJQVRPHD-UHFFFAOYSA-N
XLogP4.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.73
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide 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

2,4-dichloro-N-(4-ethylphenyl)-5-fluorobenzamide
CID 27667437
methyl 4-[(2-chloro-4-fluorobenzoyl)amino]benzoate
CID 6469488
2-amino-N-(4-ethylphenyl)-4-fluorobenzamide
CID 63109707
methyl 2-chloro-5-[(2-chloro-4-fluorobenzoyl)amino]benzoate
CID 38236031
2-chloro-N-[4-(diethylsulfamoyl)phenyl]-4-fluorobenzamide
CID 9415986
2-chloro-4-fluoro-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 26643241
2-chloro-N-(3,4-diethoxyphenyl)-4-fluorobenzamide
CID 26212713
4-[(2-chloro-4-fluorobenzoyl)amino]benzenesulfonyl chloride
CID 43096347
2-chloro-4-fluoro-N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]benzamide
CID 43110853
2-chloro-N-(4-ethylphenyl)-5-fluoropyridine-3-carboxamide
CID 103891458
1-(2-chloro-4-fluorophenyl)-2-(4-ethylphenyl)ethanone
CID 63410277
2-chloro-4-fluoro-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 8884469

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide?
The IUPAC name of 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide (CID 26697286) is 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide.
What is the SMILES notation for 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide?
The canonical SMILES for 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide is CCc1ccc(NC(=O)c2ccc(F)cc2Cl)cc1.
What is the InChIKey of 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide?
The InChIKey is YMNJZXHJQVRPHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO/c1-2-10-3-6-12(7-4-10)18-15(19)13-8-5-11(17)9-14(13)16/h3-9H,2H2,1H3,(H,18,19).
What are the key properties of 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide?
2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide has a molecular weight of 277.73 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-ethylphenyl)-4-fluorobenzamide is sourced from PubChem (CID 26697286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).