2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide

C12H17FN2O4S — CID 103941340

IUPAC2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide
SMILESCC(C)(CNC(=O)c1ccc(O)cc1F)NS(C)(=O)=O
InChIInChI=1S/C12H17FN2O4S/c1-12(2,15-20(3,18)19)7-14-11(17)9-5-4-8(16)6-10(9)13/h4-6,15-16H,7H2,1-3H3,(H,14,17)
InChIKeyGPRUJRCGAKTYKI-UHFFFAOYSA-N
MW304.34 g/mol
LogP0.59
Rot. Bonds5

About 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide

2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide (PubChem CID 103941340) has the molecular formula C12H17FN2O4S and a molecular weight of 304.34 g/mol. Its IUPAC name is 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide.

Molecular Properties

Compound Name2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide
PubChem CID103941340
Molecular FormulaC12H17FN2O4S
Molecular Weight304.34 g/mol
Exact Mass304.09
IUPAC Name2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide
SMILESCC(C)(CNC(=O)c1ccc(O)cc1F)NS(C)(=O)=O
InChIInChI=1S/C12H17FN2O4S/c1-12(2,15-20(3,18)19)7-14-11(17)9-5-4-8(16)6-10(9)13/h4-6,15-16H,7H2,1-3H3,(H,14,17)
InChIKeyGPRUJRCGAKTYKI-UHFFFAOYSA-N
XLogP0.59
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.34
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide 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

3,4,5-trifluoro-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide
CID 63862461
N-(5-amino-2,2-dimethylpentyl)-2-fluoro-4-hydroxybenzamide
CID 106141044
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-fluoro-4-hydroxybenzamide
CID 103939907
4-fluoro-N-[2-(methanesulfonamido)-2-methylpropyl]-3-methylbenzamide
CID 63862642
2-(3-hydroxyphenyl)-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide
CID 63859309
2-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]-5-methoxybenzamide
CID 63858949
N-(2-bromobutyl)-2-fluoro-4-hydroxybenzamide
CID 107677727
N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide
CID 107677101
2-fluoro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-4-carboxamide
CID 63862460
3-fluoro-N-[2-(methanesulfonamido)-2-methylpropyl]-2-(methylamino)pyridine-4-carboxamide
CID 105386402
2-fluoro-4-hydroxy-N-(2-hydroxy-4,4-dimethylpentyl)benzamide
CID 104929813
N-[(2-ethylphenyl)methyl]-2-fluoro-4-hydroxybenzamide
CID 103941364

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide?
The IUPAC name of 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide (CID 103941340) is 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide.
What is the SMILES notation for 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide?
The canonical SMILES for 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide is CC(C)(CNC(=O)c1ccc(O)cc1F)NS(C)(=O)=O.
What is the InChIKey of 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide?
The InChIKey is GPRUJRCGAKTYKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O4S/c1-12(2,15-20(3,18)19)7-14-11(17)9-5-4-8(16)6-10(9)13/h4-6,15-16H,7H2,1-3H3,(H,14,17).
What are the key properties of 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide?
2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide has a molecular weight of 304.34 g/mol, XLogP of 0.59, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide is sourced from PubChem (CID 103941340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).