N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide

C16H16FNO2 — CID 115299129

IUPACN-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide
SMILESCCc1ccccc1CNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C16H16FNO2/c1-2-11-5-3-4-6-12(11)10-18-16(20)14-9-13(17)7-8-15(14)19/h3-9,19H,2,10H2,1H3,(H,18,20)
InChIKeyOCXFYPSOKORRAL-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.02
Rot. Bonds4

About N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide

N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide (PubChem CID 115299129) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide
PubChem CID115299129
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC NameN-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide
SMILESCCc1ccccc1CNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C16H16FNO2/c1-2-11-5-3-4-6-12(11)10-18-16(20)14-9-13(17)7-8-15(14)19/h3-9,19H,2,10H2,1H3,(H,18,20)
InChIKeyOCXFYPSOKORRAL-UHFFFAOYSA-N
XLogP3.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide 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

N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide
CID 115299371
5-fluoro-N-[(2-hydroxyphenyl)methyl]-2-methylbenzamide
CID 115598801
N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide
CID 79880980
N-(2-ethylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298874
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
3-amino-N-[(2-ethylphenyl)methyl]-2,5-difluorobenzamide
CID 107121143
N-[(2-ethylphenyl)methyl]-2-fluoro-4-hydroxybenzamide
CID 103941364
5-fluoro-2-hydroxy-N-[(4-methylthiophen-3-yl)methyl]benzamide
CID 115299175
2,5-difluoro-N-[(2-methylphenyl)methyl]benzamide
CID 30500868
N-[(2-ethylphenyl)methyl]-2-fluoro-4-methylbenzamide
CID 79791419
5-fluoro-N-[(2-hydroxyphenyl)methyl]-2-nitrobenzamide
CID 115735454
N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-2-hydroxy-5-methylbenzamide
CID 46474447

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide (CID 115299129) is N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide is CCc1ccccc1CNC(=O)c1cc(F)ccc1O.
What is the InChIKey of N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide?
The InChIKey is OCXFYPSOKORRAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-2-11-5-3-4-6-12(11)10-18-16(20)14-9-13(17)7-8-15(14)19/h3-9,19H,2,10H2,1H3,(H,18,20).
What are the key properties of N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide?
N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide has a molecular weight of 273.31 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 115299129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).