N-cyclohexyl-2,2-difluoroacetamide

C8H13F2NO — CID 103600496

IUPACN-cyclohexyl-2,2-difluoroacetamide
SMILESO=C(NC1CCCCC1)C(F)F
InChIInChI=1S/C8H13F2NO/c9-7(10)8(12)11-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,11,12)
InChIKeyJOGQHMVHCHFMLE-UHFFFAOYSA-N
MW177.19 g/mol
LogP1.70
Rot. Bonds2

About N-cyclohexyl-2,2-difluoroacetamide

N-cyclohexyl-2,2-difluoroacetamide (PubChem CID 103600496) has the molecular formula C8H13F2NO and a molecular weight of 177.19 g/mol. Its IUPAC name is N-cyclohexyl-2,2-difluoroacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2,2-difluoroacetamide
PubChem CID103600496
Molecular FormulaC8H13F2NO
Molecular Weight177.19 g/mol
Exact Mass177.10
IUPAC NameN-cyclohexyl-2,2-difluoroacetamide
SMILESO=C(NC1CCCCC1)C(F)F
InChIInChI=1S/C8H13F2NO/c9-7(10)8(12)11-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,11,12)
InChIKeyJOGQHMVHCHFMLE-UHFFFAOYSA-N
XLogP1.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.19
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2,2-difluoroacetamide?
The IUPAC name of N-cyclohexyl-2,2-difluoroacetamide (CID 103600496) is N-cyclohexyl-2,2-difluoroacetamide.
What is the SMILES notation for N-cyclohexyl-2,2-difluoroacetamide?
The canonical SMILES for N-cyclohexyl-2,2-difluoroacetamide is O=C(NC1CCCCC1)C(F)F.
What is the InChIKey of N-cyclohexyl-2,2-difluoroacetamide?
The InChIKey is JOGQHMVHCHFMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2NO/c9-7(10)8(12)11-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,11,12).
What are the key properties of N-cyclohexyl-2,2-difluoroacetamide?
N-cyclohexyl-2,2-difluoroacetamide has a molecular weight of 177.19 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2,2-difluoroacetamide is sourced from PubChem (CID 103600496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).