N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide

C9H16F2N2O3 — CID 103514858

IUPACN-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide
SMILESCOCCN(CC(=O)N(C)C)C(=O)C(F)F
InChIInChI=1S/C9H16F2N2O3/c1-12(2)7(14)6-13(4-5-16-3)9(15)8(10)11/h8H,4-6H2,1-3H3
InChIKeyIQVZUIZAPGGDHY-UHFFFAOYSA-N
MW238.23 g/mol
LogP-0.19
Rot. Bonds6

About N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide

N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide (PubChem CID 103514858) has the molecular formula C9H16F2N2O3 and a molecular weight of 238.23 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide
PubChem CID103514858
Molecular FormulaC9H16F2N2O3
Molecular Weight238.23 g/mol
Exact Mass238.11
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide
SMILESCOCCN(CC(=O)N(C)C)C(=O)C(F)F
InChIInChI=1S/C9H16F2N2O3/c1-12(2)7(14)6-13(4-5-16-3)9(15)8(10)11/h8H,4-6H2,1-3H3
InChIKeyIQVZUIZAPGGDHY-UHFFFAOYSA-N
XLogP-0.19
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.23
LogP ≤ 5-0.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide (CID 103514858) is N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide is COCCN(CC(=O)N(C)C)C(=O)C(F)F.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide?
The InChIKey is IQVZUIZAPGGDHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2O3/c1-12(2)7(14)6-13(4-5-16-3)9(15)8(10)11/h8H,4-6H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide?
N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide has a molecular weight of 238.23 g/mol, XLogP of -0.19, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-2,2-difluoro-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 103514858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).