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

3-Hydroxyhippuric Acid
CID 450268
Benzamide, 4-hydroxy-N-methyl-
CID 119691
3-hydroxy-N,N-dimethylbenzamide
CID 637524
Gentisamide, N-methyl-
CID 115892
N-benzyl-3-hydroxybenzamide
CID 2394019
3-hydroxy-N-methylbenzamide
CID 353710
3-[(3-{2-[3-(Trifluoromethyl)phenyl]ethyl}-1-piperidinyl)carbonyl]phenol
CID 56866355
8-[(3-hydroxybenzoyl)amino]octanoic Acid
CID 10826528
3-Hydroxy-N-propylbenzamide
CID 18916285
4-Fluoro-3-hydroxybenzamide
CID 20776979
N-cyclopropyl-3-hydroxybenzamide
CID 28390689
4-hydroxy-N-(2,2,2-trifluoroethyl)benzamide
CID 28392790

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).