2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide

C15H17F4NO — CID 79765205

IUPAC2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide
SMILESCc1ccc(C(=O)NC2CCCCC2C(F)(F)F)c(F)c1
InChIInChI=1S/C15H17F4NO/c1-9-6-7-10(12(16)8-9)14(21)20-13-5-3-2-4-11(13)15(17,18)19/h6-8,11,13H,2-5H2,1H3,(H,20,21)
InChIKeyDHDSYDHUXCXLQU-UHFFFAOYSA-N
MW303.30 g/mol
LogP3.99
Rot. Bonds2

About 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide

2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide (PubChem CID 79765205) has the molecular formula C15H17F4NO and a molecular weight of 303.30 g/mol. Its IUPAC name is 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide.

Molecular Properties

Compound Name2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide
PubChem CID79765205
Molecular FormulaC15H17F4NO
Molecular Weight303.30 g/mol
Exact Mass303.12
IUPAC Name2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide
SMILESCc1ccc(C(=O)NC2CCCCC2C(F)(F)F)c(F)c1
InChIInChI=1S/C15H17F4NO/c1-9-6-7-10(12(16)8-9)14(21)20-13-5-3-2-4-11(13)15(17,18)19/h6-8,11,13H,2-5H2,1H3,(H,20,21)
InChIKeyDHDSYDHUXCXLQU-UHFFFAOYSA-N
XLogP3.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.30
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]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

5-chloro-2-methoxy-N-[(1R,2R)-2-(trifluoromethyl)cyclohexyl]benzamide
CID 25497376
2-fluoro-4-methyl-N-(2-methyloxolan-3-yl)benzamide
CID 82725770
2-fluoro-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-4-methylbenzamide
CID 79795341
2-fluoro-5-methyl-N-(2-methylcyclopentyl)benzamide
CID 55171474
2-iodo-N-[2-(trifluoromethyl)cyclohexyl]benzamide
CID 60722477
4-amino-3-fluoro-N-[2-(trifluoromethyl)cyclohexyl]benzamide
CID 63188254
4-amino-3-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide
CID 43712748
2-fluoro-5-methyl-N-[(1S,2S)-2-(trifluoromethyl)cyclohexyl]benzenesulfonamide
CID 39630429
2-fluoro-4-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119389290
1-(4-methoxyphenyl)-2,5-dimethyl-N-[(1R,2S)-2-(trifluoromethyl)cyclohexyl]pyrrole-3-carboxamide
CID 35245114
N-cyclohex-3-en-1-yl-2-fluoro-4-methylbenzamide
CID 79796109
2-[(2-fluoro-4-methoxybenzoyl)amino]cyclohexane-1-carboxylic acid
CID 103790786

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide?
The IUPAC name of 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide (CID 79765205) is 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide.
What is the SMILES notation for 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide?
The canonical SMILES for 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide is Cc1ccc(C(=O)NC2CCCCC2C(F)(F)F)c(F)c1.
What is the InChIKey of 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide?
The InChIKey is DHDSYDHUXCXLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F4NO/c1-9-6-7-10(12(16)8-9)14(21)20-13-5-3-2-4-11(13)15(17,18)19/h6-8,11,13H,2-5H2,1H3,(H,20,21).
What are the key properties of 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide?
2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide has a molecular weight of 303.30 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide is sourced from PubChem (CID 79765205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).