2-chloro-N,N-diethyl-2,2-difluoroacetamide

C6H10ClF2NO — CID 10241523

IUPAC2-chloro-N,N-diethyl-2,2-difluoroacetamide
SMILESCCN(CC)C(=O)C(F)(F)Cl
InChIInChI=1S/C6H10ClF2NO/c1-3-10(4-2)5(11)6(7,8)9/h3-4H2,1-2H3
InChIKeyLVLSLVAFJWKHHE-UHFFFAOYSA-N
MW185.60 g/mol
LogP1.69
Rot. Bonds3

About 2-chloro-N,N-diethyl-2,2-difluoroacetamide

2-chloro-N,N-diethyl-2,2-difluoroacetamide (PubChem CID 10241523) has the molecular formula C6H10ClF2NO and a molecular weight of 185.60 g/mol. Its IUPAC name is 2-chloro-N,N-diethyl-2,2-difluoroacetamide.

Molecular Properties

Compound Name2-chloro-N,N-diethyl-2,2-difluoroacetamide
PubChem CID10241523
Molecular FormulaC6H10ClF2NO
Molecular Weight185.60 g/mol
Exact Mass185.04
IUPAC Name2-chloro-N,N-diethyl-2,2-difluoroacetamide
SMILESCCN(CC)C(=O)C(F)(F)Cl
InChIInChI=1S/C6H10ClF2NO/c1-3-10(4-2)5(11)6(7,8)9/h3-4H2,1-2H3
InChIKeyLVLSLVAFJWKHHE-UHFFFAOYSA-N
XLogP1.69
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.60
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N,N-Diethyl-2,2,2-trifluoroacetamide
CID 225443
2-Chloro-N,N-diethyl-2-fluoroacetamide
CID 356549
2-chloro-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
CID 51889837
2-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)acetamide
CID 59842833
N,N-Diethyl-2,2-difluoroacetamide
CID 12557633
N,N-Bis(2-chloroethyl)-2,2,2-trifluoroacetamide
CID 300671
(2S)-2-chloro-N,N-diethyl-2-fluoroacetamide
CID 6931979
2,2-dichloro-N,N-diethyl-2-fluoroacetamide
CID 131856930
2,2-dichloro-N-ethyl-N-(2,2,2-trifluoroethyl)acetamide
CID 12769780
N-ethyl-N-(trifluoromethyl)acetamide
CID 21690783
N-Ethyl-N-methyltrifluoroacetamide
CID 57170952
N-ethyl-2,2-difluoro-N-methylacetamide
CID 59154831

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N,N-diethyl-2,2-difluoroacetamide?
The IUPAC name of 2-chloro-N,N-diethyl-2,2-difluoroacetamide (CID 10241523) is 2-chloro-N,N-diethyl-2,2-difluoroacetamide.
What is the SMILES notation for 2-chloro-N,N-diethyl-2,2-difluoroacetamide?
The canonical SMILES for 2-chloro-N,N-diethyl-2,2-difluoroacetamide is CCN(CC)C(=O)C(F)(F)Cl.
What is the InChIKey of 2-chloro-N,N-diethyl-2,2-difluoroacetamide?
The InChIKey is LVLSLVAFJWKHHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10ClF2NO/c1-3-10(4-2)5(11)6(7,8)9/h3-4H2,1-2H3.
What are the key properties of 2-chloro-N,N-diethyl-2,2-difluoroacetamide?
2-chloro-N,N-diethyl-2,2-difluoroacetamide has a molecular weight of 185.60 g/mol, XLogP of 1.69, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N,N-diethyl-2,2-difluoroacetamide is sourced from PubChem (CID 10241523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).