4-fluoro-N-hexan-2-yl-2-hydroxybenzamide

C13H18FNO2 — CID 107015212

IUPAC4-fluoro-N-hexan-2-yl-2-hydroxybenzamide
SMILESCCCCC(C)NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C13H18FNO2/c1-3-4-5-9(2)15-13(17)11-7-6-10(14)8-12(11)16/h6-9,16H,3-5H2,1-2H3,(H,15,17)
InChIKeyQRQBKWUXMMLWND-UHFFFAOYSA-N
MW239.29 g/mol
LogP2.84
Rot. Bonds5

About 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide

4-fluoro-N-hexan-2-yl-2-hydroxybenzamide (PubChem CID 107015212) has the molecular formula C13H18FNO2 and a molecular weight of 239.29 g/mol. Its IUPAC name is 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide.

Molecular Properties

Compound Name4-fluoro-N-hexan-2-yl-2-hydroxybenzamide
PubChem CID107015212
Molecular FormulaC13H18FNO2
Molecular Weight239.29 g/mol
Exact Mass239.13
IUPAC Name4-fluoro-N-hexan-2-yl-2-hydroxybenzamide
SMILESCCCCC(C)NC(=O)c1ccc(F)cc1O
InChIInChI=1S/C13H18FNO2/c1-3-4-5-9(2)15-13(17)11-7-6-10(14)8-12(11)16/h6-9,16H,3-5H2,1-2H3,(H,15,17)
InChIKeyQRQBKWUXMMLWND-UHFFFAOYSA-N
XLogP2.84
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-N-hexan-2-yl-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-[1-(diethylamino)propan-2-yl]-4-fluoro-2-hydroxybenzamide
CID 103829876
4-bromo-2-hydroxy-N-octan-2-ylbenzamide
CID 55223939
4-fluoro-N-hexan-2-ylbenzamide
CID 62199480
N-[1-(ethylamino)-1-oxopropan-2-yl]-4-fluoro-2-hydroxybenzamide
CID 113304525
4-fluoro-2-hydroxy-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 103829742
methyl 2-[(4-fluoro-2-hydroxybenzoyl)amino]propanoate
CID 107015165
2,3-difluoro-N-hexan-2-ylbenzamide
CID 55099872
4-fluoro-2-hydroxy-N-(4-methylpentyl)benzamide
CID 103829717
N-(1-bromobutan-2-yl)-4-fluoro-2-hydroxybenzamide
CID 107016853
(2S)-2-[(5-fluoro-2-hydroxybenzoyl)amino]hexanoic acid
CID 107144035
6-[(5-fluoro-2-hydroxybenzoyl)amino]-2-methylheptanoic acid
CID 115298555
4-fluoro-2-hydroxy-N-[3-(2-methylpropanoylamino)propyl]benzamide
CID 86814360

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide?
The IUPAC name of 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide (CID 107015212) is 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide.
What is the SMILES notation for 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide?
The canonical SMILES for 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide is CCCCC(C)NC(=O)c1ccc(F)cc1O.
What is the InChIKey of 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide?
The InChIKey is QRQBKWUXMMLWND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO2/c1-3-4-5-9(2)15-13(17)11-7-6-10(14)8-12(11)16/h6-9,16H,3-5H2,1-2H3,(H,15,17).
What are the key properties of 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide?
4-fluoro-N-hexan-2-yl-2-hydroxybenzamide has a molecular weight of 239.29 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-hexan-2-yl-2-hydroxybenzamide is sourced from PubChem (CID 107015212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).