N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide

C11H20F2N2O2 — CID 119768425

IUPACN-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide
SMILESCOCCN(CC(F)F)C(=O)CC1CCCN1
InChIInChI=1S/C11H20F2N2O2/c1-17-6-5-15(8-10(12)13)11(16)7-9-3-2-4-14-9/h9-10,14H,2-8H2,1H3
InChIKeyZGJAWDXIZNRLKN-UHFFFAOYSA-N
MW250.29 g/mol
LogP0.87
Rot. Bonds7

About N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide

N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide (PubChem CID 119768425) has the molecular formula C11H20F2N2O2 and a molecular weight of 250.29 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide
PubChem CID119768425
Molecular FormulaC11H20F2N2O2
Molecular Weight250.29 g/mol
Exact Mass250.15
IUPAC NameN-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide
SMILESCOCCN(CC(F)F)C(=O)CC1CCCN1
InChIInChI=1S/C11H20F2N2O2/c1-17-6-5-15(8-10(12)13)11(16)7-9-3-2-4-14-9/h9-10,14H,2-8H2,1H3
InChIKeyZGJAWDXIZNRLKN-UHFFFAOYSA-N
XLogP0.87
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.29
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide (CID 119768425) is N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide is COCCN(CC(F)F)C(=O)CC1CCCN1.
What is the InChIKey of N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide?
The InChIKey is ZGJAWDXIZNRLKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2N2O2/c1-17-6-5-15(8-10(12)13)11(16)7-9-3-2-4-14-9/h9-10,14H,2-8H2,1H3.
What are the key properties of N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide?
N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide has a molecular weight of 250.29 g/mol, XLogP of 0.87, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119768425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).