2-fluoro-4-methyl-N-(2-propylphenyl)benzamide

C17H18FNO — CID 79778827

IUPAC2-fluoro-4-methyl-N-(2-propylphenyl)benzamide
SMILESCCCc1ccccc1NC(=O)c1ccc(C)cc1F
InChIInChI=1S/C17H18FNO/c1-3-6-13-7-4-5-8-16(13)19-17(20)14-10-9-12(2)11-15(14)18/h4-5,7-11H,3,6H2,1-2H3,(H,19,20)
InChIKeyZIIAPXNJGQGNJZ-UHFFFAOYSA-N
MW271.33 g/mol
LogP4.34
Rot. Bonds4

About 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide

2-fluoro-4-methyl-N-(2-propylphenyl)benzamide (PubChem CID 79778827) has the molecular formula C17H18FNO and a molecular weight of 271.33 g/mol. Its IUPAC name is 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-methyl-N-(2-propylphenyl)benzamide
PubChem CID79778827
Molecular FormulaC17H18FNO
Molecular Weight271.33 g/mol
Exact Mass271.14
IUPAC Name2-fluoro-4-methyl-N-(2-propylphenyl)benzamide
SMILESCCCc1ccccc1NC(=O)c1ccc(C)cc1F
InChIInChI=1S/C17H18FNO/c1-3-6-13-7-4-5-8-16(13)19-17(20)14-10-9-12(2)11-15(14)18/h4-5,7-11H,3,6H2,1-2H3,(H,19,20)
InChIKeyZIIAPXNJGQGNJZ-UHFFFAOYSA-N
XLogP4.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.33
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-2-(methylamino)-N-(2-propylphenyl)benzamide
CID 62509909
4-fluoro-2-methyl-N-(2-propylphenyl)benzamide
CID 115745651
3,4,5-trifluoro-N-(2-propylphenyl)benzamide
CID 63188626
N-(2-ethylphenyl)-2,4-dimethylbenzamide
CID 953221
N-[2-(ethoxymethyl)phenyl]-2-fluoro-5-methylbenzamide
CID 62511294
2-fluoro-N-[2-(methoxymethyl)phenyl]-5-methylbenzamide
CID 62511821
N-[(2-ethylphenyl)methyl]-2-fluoro-4-methylbenzamide
CID 79791419
2-(ethylamino)-N-(2-fluorophenyl)-5-methylbenzamide
CID 62511053
2-fluoro-4-hydroxy-N-[2-(2-methoxyethyl)phenyl]benzamide
CID 102978268
N-[2-(ethylaminomethyl)phenyl]-2,5-difluoro-4-methylbenzamide
CID 84589201
3-bromo-4-fluoro-N-(2-propylphenyl)benzamide
CID 103706788
2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide
CID 107731680

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide?
The IUPAC name of 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide (CID 79778827) is 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide.
What is the SMILES notation for 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide?
The canonical SMILES for 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide is CCCc1ccccc1NC(=O)c1ccc(C)cc1F.
What is the InChIKey of 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide?
The InChIKey is ZIIAPXNJGQGNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-3-6-13-7-4-5-8-16(13)19-17(20)14-10-9-12(2)11-15(14)18/h4-5,7-11H,3,6H2,1-2H3,(H,19,20).
What are the key properties of 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide?
2-fluoro-4-methyl-N-(2-propylphenyl)benzamide has a molecular weight of 271.33 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-N-(2-propylphenyl)benzamide is sourced from PubChem (CID 79778827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).