N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide

C15H15F6NO — CID 164895040

IUPACN-cyclohexyl-2,6-bis(trifluoromethyl)benzamide
SMILESO=C(NC1CCCCC1)c1c(C(F)(F)F)cccc1C(F)(F)F
InChIInChI=1S/C15H15F6NO/c16-14(17,18)10-7-4-8-11(15(19,20)21)12(10)13(23)22-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,22,23)
InChIKeyLKUDSDYVMJVRPX-UHFFFAOYSA-N
MW339.28 g/mol
LogP4.79
Rot. Bonds2

About N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide

N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide (PubChem CID 164895040) has the molecular formula C15H15F6NO and a molecular weight of 339.28 g/mol. Its IUPAC name is N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-2,6-bis(trifluoromethyl)benzamide
PubChem CID164895040
Molecular FormulaC15H15F6NO
Molecular Weight339.28 g/mol
Exact Mass339.11
IUPAC NameN-cyclohexyl-2,6-bis(trifluoromethyl)benzamide
SMILESO=C(NC1CCCCC1)c1c(C(F)(F)F)cccc1C(F)(F)F
InChIInChI=1S/C15H15F6NO/c16-14(17,18)10-7-4-8-11(15(19,20)21)12(10)13(23)22-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,22,23)
InChIKeyLKUDSDYVMJVRPX-UHFFFAOYSA-N
XLogP4.79
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.28
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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N-[2-(cycloheptylamino)ethyl]-2-(trifluoromethyl)benzamide
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CID 607051
2-N-cycloheptyl-6-N-cyclohexylpyridine-2,6-dicarboxamide
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N-cycloheptyl-2,2-dimethyl-N'-[2-(trifluoromethyl)phenyl]propanediamide
CID 108966127
2-fluoro-N-(4-hydroxycyclohexyl)-3-(trifluoromethyl)benzamide
CID 79884389
N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide?
The IUPAC name of N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide (CID 164895040) is N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide.
What is the SMILES notation for N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide?
The canonical SMILES for N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide is O=C(NC1CCCCC1)c1c(C(F)(F)F)cccc1C(F)(F)F.
What is the InChIKey of N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide?
The InChIKey is LKUDSDYVMJVRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F6NO/c16-14(17,18)10-7-4-8-11(15(19,20)21)12(10)13(23)22-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,22,23).
What are the key properties of N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide?
N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide has a molecular weight of 339.28 g/mol, XLogP of 4.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2,6-bis(trifluoromethyl)benzamide is sourced from PubChem (CID 164895040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).