N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide

C11H15FN2O2 — CID 107677101

IUPACN-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide
SMILESCC(C)(CN)NC(=O)c1ccc(O)cc1F
InChIInChI=1S/C11H15FN2O2/c1-11(2,6-13)14-10(16)8-4-3-7(15)5-9(8)12/h3-5,15H,6,13H2,1-2H3,(H,14,16)
InChIKeyZQOLOSXNPQQOEZ-UHFFFAOYSA-N
MW226.25 g/mol
LogP1.00
Rot. Bonds3

About N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide

N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide (PubChem CID 107677101) has the molecular formula C11H15FN2O2 and a molecular weight of 226.25 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide
PubChem CID107677101
Molecular FormulaC11H15FN2O2
Molecular Weight226.25 g/mol
Exact Mass226.11
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide
SMILESCC(C)(CN)NC(=O)c1ccc(O)cc1F
InChIInChI=1S/C11H15FN2O2/c1-11(2,6-13)14-10(16)8-4-3-7(15)5-9(8)12/h3-5,15H,6,13H2,1-2H3,(H,14,16)
InChIKeyZQOLOSXNPQQOEZ-UHFFFAOYSA-N
XLogP1.00
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-4-bromo-2-fluorobenzamide
CID 63193839
N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-(4-methylphenyl)benzamide;hydrochloride
CID 119521671
N-(1-amino-2-methylpropan-2-yl)-2,4-difluoro-5-methylbenzamide
CID 112701308
N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-(4-methoxyphenyl)benzamide;hydrochloride
CID 119523732
N-(5-amino-2,2-dimethylpentyl)-2-fluoro-4-hydroxybenzamide
CID 106141044
N-[1-bromo-2-(bromomethyl)butan-2-yl]-2-fluoro-4-hydroxybenzamide
CID 107868120
N-(1-chloro-3-methylpentan-3-yl)-2-fluoro-4-hydroxybenzamide
CID 106168256
N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-(2-fluoro-4-methoxyphenyl)benzamide;hydrochloride
CID 119523159
N-(1-amino-2-methylpropan-2-yl)-2,4-dichloro-5-fluorobenzamide;hydrochloride
CID 119521536
N-(1-bromo-2-methylpropan-2-yl)-2,4-difluorobenzamide
CID 114308135
N-(1-aminobutan-2-yl)-2-fluoro-4-hydroxybenzamide
CID 107677142
2-fluoro-4-hydroxy-N-[2-(methanesulfonamido)-2-methylpropyl]benzamide
CID 103941340

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide (CID 107677101) is N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide is CC(C)(CN)NC(=O)c1ccc(O)cc1F.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide?
The InChIKey is ZQOLOSXNPQQOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O2/c1-11(2,6-13)14-10(16)8-4-3-7(15)5-9(8)12/h3-5,15H,6,13H2,1-2H3,(H,14,16).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide?
N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide has a molecular weight of 226.25 g/mol, XLogP of 1.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-2-fluoro-4-hydroxybenzamide is sourced from PubChem (CID 107677101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).