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

C10H17F2NO3 — CID 107482884

IUPACN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide
SMILESO=C(CC1CCCO1)N(CCO)CC(F)F
InChIInChI=1S/C10H17F2NO3/c11-9(12)7-13(3-4-14)10(15)6-8-2-1-5-16-8/h8-9,14H,1-7H2
InChIKeyGPDWCJLLBIJDRV-UHFFFAOYSA-N
MW237.25 g/mol
LogP0.64
Rot. Bonds6

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

N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide (PubChem CID 107482884) has the molecular formula C10H17F2NO3 and a molecular weight of 237.25 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide
PubChem CID107482884
Molecular FormulaC10H17F2NO3
Molecular Weight237.25 g/mol
Exact Mass237.12
IUPAC NameN-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide
SMILESO=C(CC1CCCO1)N(CCO)CC(F)F
InChIInChI=1S/C10H17F2NO3/c11-9(12)7-13(3-4-14)10(15)6-8-2-1-5-16-8/h8-9,14H,1-7H2
InChIKeyGPDWCJLLBIJDRV-UHFFFAOYSA-N
XLogP0.64
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 50.64
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-(oxolan-2-yl)acetamide?
The IUPAC name of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide (CID 107482884) is N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide?
The canonical SMILES for N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide is O=C(CC1CCCO1)N(CCO)CC(F)F.
What is the InChIKey of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide?
The InChIKey is GPDWCJLLBIJDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F2NO3/c11-9(12)7-13(3-4-14)10(15)6-8-2-1-5-16-8/h8-9,14H,1-7H2.
What are the key properties of N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide?
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(oxolan-2-yl)acetamide has a molecular weight of 237.25 g/mol, XLogP of 0.64, 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-(oxolan-2-yl)acetamide is sourced from PubChem (CID 107482884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).