N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide

C15H19F2NO — CID 17067316

IUPACN-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide
SMILESCc1cc(C(=O)NC2CCCCC2)c(C)c(F)c1F
InChIInChI=1S/C15H19F2NO/c1-9-8-12(10(2)14(17)13(9)16)15(19)18-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3,(H,18,19)
InChIKeyCUQOSOJKAMDKOH-UHFFFAOYSA-N
MW267.32 g/mol
LogP3.64
Rot. Bonds2

About N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide

N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide (PubChem CID 17067316) has the molecular formula C15H19F2NO and a molecular weight of 267.32 g/mol. Its IUPAC name is N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide.

Molecular Properties

Compound NameN-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide
PubChem CID17067316
Molecular FormulaC15H19F2NO
Molecular Weight267.32 g/mol
Exact Mass267.14
IUPAC NameN-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide
SMILESCc1cc(C(=O)NC2CCCCC2)c(C)c(F)c1F
InChIInChI=1S/C15H19F2NO/c1-9-8-12(10(2)14(17)13(9)16)15(19)18-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3,(H,18,19)
InChIKeyCUQOSOJKAMDKOH-UHFFFAOYSA-N
XLogP3.64
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cycloheptyl-2-fluoro-3-methylbenzamide
CID 80719060
5-chloro-N-cyclohexyl-2,3-difluoro-4-methylbenzamide
CID 17067296
N-cyclohexyl-2,5-dimethylbenzamide
CID 925443
N-cyclododecyl-2,4-dimethylbenzamide
CID 19656258
N-cyclobutyl-2-fluoro-3-methylbenzamide
CID 80712137
5-chloro-N-cyclohexyl-2-methylbenzamide
CID 83407385
N-cyclohexyl-5-fluoro-2-methyl-3-sulfamoylbenzamide
CID 65373979
5-chloro-N-cycloheptyl-2-fluorobenzamide
CID 9082182
4-chloro-N-cycloheptyl-2-fluorobenzamide
CID 26002204
N-cycloheptyl-4-hydrazinyl-2-methylbenzamide
CID 113400294
N-cyclopentyl-3-hydroxy-2-methylbenzamide
CID 82786265
2-amino-N-cycloheptyl-4-fluorobenzamide
CID 55139018

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide?
The IUPAC name of N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide (CID 17067316) is N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide.
What is the SMILES notation for N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide?
The canonical SMILES for N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide is Cc1cc(C(=O)NC2CCCCC2)c(C)c(F)c1F.
What is the InChIKey of N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide?
The InChIKey is CUQOSOJKAMDKOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2NO/c1-9-8-12(10(2)14(17)13(9)16)15(19)18-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3,(H,18,19).
What are the key properties of N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide?
N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide has a molecular weight of 267.32 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3,4-difluoro-2,5-dimethylbenzamide is sourced from PubChem (CID 17067316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).