N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide

C16H16FNO2 — CID 103888049

IUPACN-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide
SMILESCc1ccc(N(C)C(=O)c2ccc(F)cc2O)c(C)c1
InChIInChI=1S/C16H16FNO2/c1-10-4-7-14(11(2)8-10)18(3)16(20)13-6-5-12(17)9-15(13)19/h4-9,19H,1-3H3
InChIKeyKXLGNWNMIKUBGH-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.42
Rot. Bonds2

About N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide

N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide (PubChem CID 103888049) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide
PubChem CID103888049
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC NameN-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide
SMILESCc1ccc(N(C)C(=O)c2ccc(F)cc2O)c(C)c1
InChIInChI=1S/C16H16FNO2/c1-10-4-7-14(11(2)8-10)18(3)16(20)13-6-5-12(17)9-15(13)19/h4-9,19H,1-3H3
InChIKeyKXLGNWNMIKUBGH-UHFFFAOYSA-N
XLogP3.42
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-dimethylphenyl)-2,3-difluoro-N-methylpyridine-4-carboxamide
CID 105381112
N-(2-amino-5-chlorophenyl)-4-fluoro-2-hydroxy-N-methylbenzamide
CID 107465812
5-fluoro-2-(N,2,4-trimethylanilino)benzoic acid
CID 63536667
N-(2,4-dimethylphenyl)-2-iodo-N-methylbenzamide
CID 47313258
3-amino-N-(2,4-dimethylphenyl)-4-fluoro-N-methylbenzamide
CID 62001405
5-fluoro-2-hydroxy-N-methyl-N-(4-methylphenyl)benzamide
CID 115299057
3-amino-N-(2,4-dimethylphenyl)-N,4-dimethylbenzamide
CID 62003677
2-bromo-N-(2,4-dimethylphenyl)-N-methyl-5-sulfanylbenzamide
CID 107027687
4-fluoro-2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 103829572
N-(3-aminophenyl)-4-fluoro-2-hydroxy-N-methylbenzamide
CID 107013206
2-[(4-fluoro-2-hydroxybenzoyl)-methylamino]acetic acid
CID 107013339
N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide
CID 103887364

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide?
The IUPAC name of N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide (CID 103888049) is N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide is Cc1ccc(N(C)C(=O)c2ccc(F)cc2O)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide?
The InChIKey is KXLGNWNMIKUBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-10-4-7-14(11(2)8-10)18(3)16(20)13-6-5-12(17)9-15(13)19/h4-9,19H,1-3H3.
What are the key properties of N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide?
N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide has a molecular weight of 273.31 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-4-fluoro-2-hydroxy-N-methylbenzamide is sourced from PubChem (CID 103888049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).