N-cyclohexyl-2,6-difluorobenzamide

C13H15F2NO — CID 730500

IUPACN-cyclohexyl-2,6-difluorobenzamide
SMILESO=C(NC1CCCCC1)c1c(F)cccc1F
InChIInChI=1S/C13H15F2NO/c14-10-7-4-8-11(15)12(10)13(17)16-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,16,17)
InChIKeyFYVDIOFVZFVINF-UHFFFAOYSA-N
MW239.26 g/mol
LogP3.03
Rot. Bonds2

About N-cyclohexyl-2,6-difluorobenzamide

N-cyclohexyl-2,6-difluorobenzamide (PubChem CID 730500) has the molecular formula C13H15F2NO and a molecular weight of 239.26 g/mol. Its IUPAC name is N-cyclohexyl-2,6-difluorobenzamide.

Molecular Properties

Compound NameN-cyclohexyl-2,6-difluorobenzamide
PubChem CID730500
Molecular FormulaC13H15F2NO
Molecular Weight239.26 g/mol
Exact Mass239.11
IUPAC NameN-cyclohexyl-2,6-difluorobenzamide
SMILESO=C(NC1CCCCC1)c1c(F)cccc1F
InChIInChI=1S/C13H15F2NO/c14-10-7-4-8-11(15)12(10)13(17)16-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,16,17)
InChIKeyFYVDIOFVZFVINF-UHFFFAOYSA-N
XLogP3.03
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.26
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2,6-difluorobenzamide?
The IUPAC name of N-cyclohexyl-2,6-difluorobenzamide (CID 730500) is N-cyclohexyl-2,6-difluorobenzamide.
What is the SMILES notation for N-cyclohexyl-2,6-difluorobenzamide?
The canonical SMILES for N-cyclohexyl-2,6-difluorobenzamide is O=C(NC1CCCCC1)c1c(F)cccc1F.
What is the InChIKey of N-cyclohexyl-2,6-difluorobenzamide?
The InChIKey is FYVDIOFVZFVINF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F2NO/c14-10-7-4-8-11(15)12(10)13(17)16-9-5-2-1-3-6-9/h4,7-9H,1-3,5-6H2,(H,16,17).
What are the key properties of N-cyclohexyl-2,6-difluorobenzamide?
N-cyclohexyl-2,6-difluorobenzamide has a molecular weight of 239.26 g/mol, XLogP of 3.03, 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-difluorobenzamide is sourced from PubChem (CID 730500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).