3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide

C9H8F3NO2 — CID 67415645

IUPAC3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide
SMILESCNC(=O)c1cc(O)cc(C(F)(F)F)c1
InChIInChI=1S/C9H8F3NO2/c1-13-8(15)5-2-6(9(10,11)12)4-7(14)3-5/h2-4,14H,1H3,(H,13,15)
InChIKeyRUOZGQZNZCWCLX-UHFFFAOYSA-N
MW219.16 g/mol
LogP1.77
Rot. Bonds1

About 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide

3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide (PubChem CID 67415645) has the molecular formula C9H8F3NO2 and a molecular weight of 219.16 g/mol. Its IUPAC name is 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide
PubChem CID67415645
Molecular FormulaC9H8F3NO2
Molecular Weight219.16 g/mol
Exact Mass219.05
IUPAC Name3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide
SMILESCNC(=O)c1cc(O)cc(C(F)(F)F)c1
InChIInChI=1S/C9H8F3NO2/c1-13-8(15)5-2-6(9(10,11)12)4-7(14)3-5/h2-4,14H,1H3,(H,13,15)
InChIKeyRUOZGQZNZCWCLX-UHFFFAOYSA-N
XLogP1.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.16
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-4-methylphenyl)-3-hydroxy-5-(trifluoromethyl)benzamide
CID 143654172
1-N,3-N,5-N-trimethylbenzene-1,3,5-tricarboxamide
CID 22943140
N-[3-(difluoromethyl)-5-methyl-1H-pyrazol-4-yl]-3-hydroxy-5-(trifluoromethyl)benzamide
CID 138989815
3-hydroxy-5-methoxy-N-methylbenzamide
CID 59127123
N,2-dimethyl-6-(trifluoromethyl)pyridine-4-carboxamide
CID 176676959
[[3,5-bis(trifluoromethyl)benzoyl]amino]thiourea
CID 2743161
N-methyl-4-[4-(trifluoromethyl)phenoxy]benzamide
CID 146305988
3,5-bis(trifluoromethyl)benzoic acid;ethane
CID 143967931
3-methyl-N-propyl-5-(trifluoromethyl)benzamide
CID 71119889
N'-(3-hydroxybenzoyl)-3-(trifluoromethyl)benzohydrazide
CID 17393057
N-(4-acetamidophenyl)-3,5-bis(trifluoromethyl)benzamide
CID 4842174
3-hydroxy-N-[[(3S)-oxan-3-yl]methyl]-5-(trifluoromethyl)benzamide
CID 125420338

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide?
The IUPAC name of 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide (CID 67415645) is 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide.
What is the SMILES notation for 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide?
The canonical SMILES for 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide is CNC(=O)c1cc(O)cc(C(F)(F)F)c1.
What is the InChIKey of 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide?
The InChIKey is RUOZGQZNZCWCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3NO2/c1-13-8(15)5-2-6(9(10,11)12)4-7(14)3-5/h2-4,14H,1H3,(H,13,15).
What are the key properties of 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide?
3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide has a molecular weight of 219.16 g/mol, XLogP of 1.77, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-methyl-5-(trifluoromethyl)benzamide is sourced from PubChem (CID 67415645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).