N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide

C11H19F2NO2 — CID 103515965

IUPACN-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide
SMILESCCC1(CC)CC(NC(=O)C(F)F)CCO1
InChIInChI=1S/C11H19F2NO2/c1-3-11(4-2)7-8(5-6-16-11)14-10(15)9(12)13/h8-9H,3-7H2,1-2H3,(H,14,15)
InChIKeyYQCPRPLYASUWLV-UHFFFAOYSA-N
MW235.27 g/mol
LogP2.11
Rot. Bonds4

About N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide

N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide (PubChem CID 103515965) has the molecular formula C11H19F2NO2 and a molecular weight of 235.27 g/mol. Its IUPAC name is N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide.

Molecular Properties

Compound NameN-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide
PubChem CID103515965
Molecular FormulaC11H19F2NO2
Molecular Weight235.27 g/mol
Exact Mass235.14
IUPAC NameN-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide
SMILESCCC1(CC)CC(NC(=O)C(F)F)CCO1
InChIInChI=1S/C11H19F2NO2/c1-3-11(4-2)7-8(5-6-16-11)14-10(15)9(12)13/h8-9H,3-7H2,1-2H3,(H,14,15)
InChIKeyYQCPRPLYASUWLV-UHFFFAOYSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.27
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide?
The IUPAC name of N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide (CID 103515965) is N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide.
What is the SMILES notation for N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide?
The canonical SMILES for N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide is CCC1(CC)CC(NC(=O)C(F)F)CCO1.
What is the InChIKey of N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide?
The InChIKey is YQCPRPLYASUWLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F2NO2/c1-3-11(4-2)7-8(5-6-16-11)14-10(15)9(12)13/h8-9H,3-7H2,1-2H3,(H,14,15).
What are the key properties of N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide?
N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide has a molecular weight of 235.27 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diethyloxan-4-yl)-2,2-difluoroacetamide is sourced from PubChem (CID 103515965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).