4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide

C16H16FNO2 — CID 107015172

IUPAC4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide
SMILESCc1ccccc1C(C)NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C16H16FNO2/c1-10-5-3-4-6-13(10)11(2)18-16(20)14-8-7-12(17)9-15(14)19/h3-9,11,19H,1-2H3,(H,18,20)
InChIKeyYCQTXQWBTZXSDE-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.33
Rot. Bonds3

About 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide

4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide (PubChem CID 107015172) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide
PubChem CID107015172
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide
SMILESCc1ccccc1C(C)NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C16H16FNO2/c1-10-5-3-4-6-13(10)11(2)18-16(20)14-8-7-12(17)9-15(14)19/h3-9,11,19H,1-2H3,(H,18,20)
InChIKeyYCQTXQWBTZXSDE-UHFFFAOYSA-N
XLogP3.33
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-4-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 79770895
3-amino-2,5-difluoro-N-[1-(2-methylphenyl)ethyl]benzamide
CID 107120653
2,4-difluoro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide
CID 24594478
N-[1-(2-chlorophenyl)ethyl]-5-fluoro-2-hydroxybenzamide
CID 115298970
2,5-dimethyl-N-[(1S)-1-(2-methylphenyl)ethyl]benzamide
CID 31178331
N-[1-(2-chlorophenyl)ethyl]-2,4-dihydroxybenzamide
CID 103600135
N-[1-(3-bromophenyl)ethyl]-4-fluoro-2-hydroxybenzamide
CID 107015012
N-[1-(5-fluoro-2-methoxyphenyl)ethyl]-2-hydroxy-4-methoxybenzamide
CID 112836868
3,4-dihydroxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 103955435
2-methoxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 18111879
methyl 2-[(4-fluoro-2-hydroxybenzoyl)amino]propanoate
CID 107015165
5-bromo-2-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 65311896

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide?
The IUPAC name of 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide (CID 107015172) is 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide?
The canonical SMILES for 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide is Cc1ccccc1C(C)NC(=O)c1ccc(F)cc1O.
What is the InChIKey of 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide?
The InChIKey is YCQTXQWBTZXSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-10-5-3-4-6-13(10)11(2)18-16(20)14-8-7-12(17)9-15(14)19/h3-9,11,19H,1-2H3,(H,18,20).
What are the key properties of 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide?
4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide has a molecular weight of 273.31 g/mol, XLogP of 3.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 107015172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).