2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide

C6H12F2N2O2 — CID 107484929

IUPAC2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
SMILESNC(=O)CN(CCO)CC(F)F
InChIInChI=1S/C6H12F2N2O2/c7-5(8)3-10(1-2-11)4-6(9)12/h5,11H,1-4H2,(H2,9,12)
InChIKeyPAGFXMMKMIQAHX-UHFFFAOYSA-N
MW182.17 g/mol
LogP-0.97
Rot. Bonds6

About 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide

2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide (PubChem CID 107484929) has the molecular formula C6H12F2N2O2 and a molecular weight of 182.17 g/mol. Its IUPAC name is 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide.

Molecular Properties

Compound Name2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
PubChem CID107484929
Molecular FormulaC6H12F2N2O2
Molecular Weight182.17 g/mol
Exact Mass182.09
IUPAC Name2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide
SMILESNC(=O)CN(CCO)CC(F)F
InChIInChI=1S/C6H12F2N2O2/c7-5(8)3-10(1-2-11)4-6(9)12/h5,11H,1-4H2,(H2,9,12)
InChIKeyPAGFXMMKMIQAHX-UHFFFAOYSA-N
XLogP-0.97
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.17
LogP ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
The IUPAC name of 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide (CID 107484929) is 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide.
What is the SMILES notation for 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
The canonical SMILES for 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide is NC(=O)CN(CCO)CC(F)F.
What is the InChIKey of 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
The InChIKey is PAGFXMMKMIQAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12F2N2O2/c7-5(8)3-10(1-2-11)4-6(9)12/h5,11H,1-4H2,(H2,9,12).
What are the key properties of 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide?
2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide has a molecular weight of 182.17 g/mol, XLogP of -0.97, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,2-difluoroethyl(2-hydroxyethyl)amino]acetamide is sourced from PubChem (CID 107484929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).