N,N-diethyl-2,2-difluorobutanamide

C8H15F2NO — CID 10877713

IUPACN,N-diethyl-2,2-difluorobutanamide
SMILESCCN(CC)C(=O)C(F)(F)CC
InChIInChI=1S/C8H15F2NO/c1-4-8(9,10)7(12)11(5-2)6-3/h4-6H2,1-3H3
InChIKeyAZDSHFYURHWAPT-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.90
Rot. Bonds4

About N,N-diethyl-2,2-difluorobutanamide

N,N-diethyl-2,2-difluorobutanamide (PubChem CID 10877713) has the molecular formula C8H15F2NO and a molecular weight of 179.21 g/mol. Its IUPAC name is N,N-diethyl-2,2-difluorobutanamide.

Molecular Properties

Compound NameN,N-diethyl-2,2-difluorobutanamide
PubChem CID10877713
Molecular FormulaC8H15F2NO
Molecular Weight179.21 g/mol
Exact Mass179.11
IUPAC NameN,N-diethyl-2,2-difluorobutanamide
SMILESCCN(CC)C(=O)C(F)(F)CC
InChIInChI=1S/C8H15F2NO/c1-4-8(9,10)7(12)11(5-2)6-3/h4-6H2,1-3H3
InChIKeyAZDSHFYURHWAPT-UHFFFAOYSA-N
XLogP1.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2,2-difluorobutanamide?
The IUPAC name of N,N-diethyl-2,2-difluorobutanamide (CID 10877713) is N,N-diethyl-2,2-difluorobutanamide.
What is the SMILES notation for N,N-diethyl-2,2-difluorobutanamide?
The canonical SMILES for N,N-diethyl-2,2-difluorobutanamide is CCN(CC)C(=O)C(F)(F)CC.
What is the InChIKey of N,N-diethyl-2,2-difluorobutanamide?
The InChIKey is AZDSHFYURHWAPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO/c1-4-8(9,10)7(12)11(5-2)6-3/h4-6H2,1-3H3.
What are the key properties of N,N-diethyl-2,2-difluorobutanamide?
N,N-diethyl-2,2-difluorobutanamide has a molecular weight of 179.21 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2,2-difluorobutanamide is sourced from PubChem (CID 10877713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).