N-(2-ethylphenyl)-2,3-difluorobenzamide

C15H13F2NO — CID 62650811

IUPACN-(2-ethylphenyl)-2,3-difluorobenzamide
SMILESCCc1ccccc1NC(=O)c1cccc(F)c1F
InChIInChI=1S/C15H13F2NO/c1-2-10-6-3-4-9-13(10)18-15(19)11-7-5-8-12(16)14(11)17/h3-9H,2H2,1H3,(H,18,19)
InChIKeyWSSQXWNGWYGWSZ-UHFFFAOYSA-N
MW261.27 g/mol
LogP3.78
Rot. Bonds3

About N-(2-ethylphenyl)-2,3-difluorobenzamide

N-(2-ethylphenyl)-2,3-difluorobenzamide (PubChem CID 62650811) has the molecular formula C15H13F2NO and a molecular weight of 261.27 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2,3-difluorobenzamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2,3-difluorobenzamide
PubChem CID62650811
Molecular FormulaC15H13F2NO
Molecular Weight261.27 g/mol
Exact Mass261.10
IUPAC NameN-(2-ethylphenyl)-2,3-difluorobenzamide
SMILESCCc1ccccc1NC(=O)c1cccc(F)c1F
InChIInChI=1S/C15H13F2NO/c1-2-10-6-3-4-9-13(10)18-15(19)11-7-5-8-12(16)14(11)17/h3-9H,2H2,1H3,(H,18,19)
InChIKeyWSSQXWNGWYGWSZ-UHFFFAOYSA-N
XLogP3.78
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337
N-(2-ethylphenyl)-2-[(4-fluorobenzoyl)amino]benzamide
CID 58758751
N-(2-ethylphenyl)-2,3-dimethylbenzamide
CID 7923827
N-(2-ethylphenyl)-2-methylsulfanylbenzamide
CID 973960
2,3,4-trifluoro-N-[2-(hydroxymethyl)phenyl]benzamide
CID 79749595
2,3,4-trifluoro-N-[2-(methylaminomethyl)phenyl]benzamide
CID 79755148
3-(4-chloro-3-hydroxyphenyl)-N-(2-ethylphenyl)-2-fluorobenzamide
CID 169205454
N-(2-ethylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298874
N-(2,3-difluorophenyl)-2,3-dihydroxybenzamide
CID 114344008
2-[(2,3-difluorobenzoyl)amino]benzenesulfonyl fluoride
CID 116814244
3-bromo-N-[2-(chloromethyl)phenyl]-2-fluorobenzamide
CID 107956658
3-N-(2-ethylphenyl)-1-N-[(2-fluorophenyl)methyl]benzene-1,3-dicarboxamide
CID 109054619

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2,3-difluorobenzamide?
The IUPAC name of N-(2-ethylphenyl)-2,3-difluorobenzamide (CID 62650811) is N-(2-ethylphenyl)-2,3-difluorobenzamide.
What is the SMILES notation for N-(2-ethylphenyl)-2,3-difluorobenzamide?
The canonical SMILES for N-(2-ethylphenyl)-2,3-difluorobenzamide is CCc1ccccc1NC(=O)c1cccc(F)c1F.
What is the InChIKey of N-(2-ethylphenyl)-2,3-difluorobenzamide?
The InChIKey is WSSQXWNGWYGWSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO/c1-2-10-6-3-4-9-13(10)18-15(19)11-7-5-8-12(16)14(11)17/h3-9H,2H2,1H3,(H,18,19).
What are the key properties of N-(2-ethylphenyl)-2,3-difluorobenzamide?
N-(2-ethylphenyl)-2,3-difluorobenzamide has a molecular weight of 261.27 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2,3-difluorobenzamide is sourced from PubChem (CID 62650811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).