N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide

C16H16FNO — CID 7751902

IUPACN-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide
SMILESCc1cc(F)ccc1NC(=O)c1cccc(C)c1C
InChIInChI=1S/C16H16FNO/c1-10-5-4-6-14(12(10)3)16(19)18-15-8-7-13(17)9-11(15)2/h4-9H,1-3H3,(H,18,19)
InChIKeyZKLORSVZTHTNPQ-UHFFFAOYSA-N
MW257.31 g/mol
LogP4.00
Rot. Bonds2

About N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide

N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide (PubChem CID 7751902) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide
PubChem CID7751902
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC NameN-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide
SMILESCc1cc(F)ccc1NC(=O)c1cccc(C)c1C
InChIInChI=1S/C16H16FNO/c1-10-5-4-6-14(12(10)3)16(19)18-15-8-7-13(17)9-11(15)2/h4-9H,1-3H3,(H,18,19)
InChIKeyZKLORSVZTHTNPQ-UHFFFAOYSA-N
XLogP4.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(5-fluoro-2-methylphenyl)-2,3-dimethylbenzamide
CID 7777709
1-N,2-N-bis(4-fluoro-2-methylphenyl)benzene-1,2-dicarboxamide
CID 2811694
N-(4-fluoro-2-methylphenyl)-2-iodobenzamide
CID 7924517
2-(ethylamino)-N-(4-fluoro-2-methylphenyl)benzamide
CID 62165548
2-bromo-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 9192994
2-chloro-4-fluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 6468797
N-(4-fluoro-2-methylphenyl)-4,5-dimethylthiophene-3-carboxamide
CID 17069419
2,3,4,5-tetrafluoro-N-(4-fluoro-2-methylphenyl)benzamide
CID 2397902
N-(4-fluoro-2-methylphenyl)-3-methylbenzamide
CID 2550656
3-amino-N-(2,4-difluorophenyl)-2-methylbenzamide
CID 16791308
3-amino-N-(5-fluoro-2-methylphenyl)-2-methylbenzamide
CID 16784018
2-bromo-N-(2,3-dimethylphenyl)-5-fluorobenzamide
CID 24695663

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide (CID 7751902) is N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide is Cc1cc(F)ccc1NC(=O)c1cccc(C)c1C.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide?
The InChIKey is ZKLORSVZTHTNPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c1-10-5-4-6-14(12(10)3)16(19)18-15-8-7-13(17)9-11(15)2/h4-9H,1-3H3,(H,18,19).
What are the key properties of N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide?
N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide has a molecular weight of 257.31 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-2,3-dimethylbenzamide is sourced from PubChem (CID 7751902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).