N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide

C11H19F2NO3 — CID 107482335

IUPACN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide
SMILESO=C(CC1CCCCO1)N(CCO)CC(F)F
InChIInChI=1S/C11H19F2NO3/c12-10(13)8-14(4-5-15)11(16)7-9-3-1-2-6-17-9/h9-10,15H,1-8H2
InChIKeyGJQZRAWIDIGIIH-UHFFFAOYSA-N
MW251.27 g/mol
LogP1.03
Rot. Bonds6

About N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide (PubChem CID 107482335) has the molecular formula C11H19F2NO3 and a molecular weight of 251.27 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide
PubChem CID107482335
Molecular FormulaC11H19F2NO3
Molecular Weight251.27 g/mol
Exact Mass251.13
IUPAC NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide
SMILESO=C(CC1CCCCO1)N(CCO)CC(F)F
InChIInChI=1S/C11H19F2NO3/c12-10(13)8-14(4-5-15)11(16)7-9-3-1-2-6-17-9/h9-10,15H,1-8H2
InChIKeyGJQZRAWIDIGIIH-UHFFFAOYSA-N
XLogP1.03
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.27
LogP ≤ 51.03
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-hydroxyethyl)-2-(oxan-2-yl)acetamide?
The IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide (CID 107482335) is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide?
The canonical SMILES for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide is O=C(CC1CCCCO1)N(CCO)CC(F)F.
What is the InChIKey of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide?
The InChIKey is GJQZRAWIDIGIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F2NO3/c12-10(13)8-14(4-5-15)11(16)7-9-3-1-2-6-17-9/h9-10,15H,1-8H2.
What are the key properties of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide?
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxan-2-yl)acetamide has a molecular weight of 251.27 g/mol, XLogP of 1.03, 6 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-hydroxyethyl)-2-(oxan-2-yl)acetamide is sourced from PubChem (CID 107482335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).