N-(2-ethoxypropyl)-2,2-difluoroacetamide

C7H13F2NO2 — CID 103516048

IUPACN-(2-ethoxypropyl)-2,2-difluoroacetamide
SMILESCCOC(C)CNC(=O)C(F)F
InChIInChI=1S/C7H13F2NO2/c1-3-12-5(2)4-10-7(11)6(8)9/h5-6H,3-4H2,1-2H3,(H,10,11)
InChIKeyVVGWULXZCIPCCF-UHFFFAOYSA-N
MW181.18 g/mol
LogP0.79
Rot. Bonds5

About N-(2-ethoxypropyl)-2,2-difluoroacetamide

N-(2-ethoxypropyl)-2,2-difluoroacetamide (PubChem CID 103516048) has the molecular formula C7H13F2NO2 and a molecular weight of 181.18 g/mol. Its IUPAC name is N-(2-ethoxypropyl)-2,2-difluoroacetamide.

Molecular Properties

Compound NameN-(2-ethoxypropyl)-2,2-difluoroacetamide
PubChem CID103516048
Molecular FormulaC7H13F2NO2
Molecular Weight181.18 g/mol
Exact Mass181.09
IUPAC NameN-(2-ethoxypropyl)-2,2-difluoroacetamide
SMILESCCOC(C)CNC(=O)C(F)F
InChIInChI=1S/C7H13F2NO2/c1-3-12-5(2)4-10-7(11)6(8)9/h5-6H,3-4H2,1-2H3,(H,10,11)
InChIKeyVVGWULXZCIPCCF-UHFFFAOYSA-N
XLogP0.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.18
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,3,3,4,4,4-Heptafluoro-N-(2-methoxyethyl)butanamide
CID 3255117
2,2,2-trifluoro-N-(2-methoxyethyl)acetamide
CID 4104851
Isopropyl [(trifluoroacetyl)amino]acetate
CID 529794
1-Acetamidopropan-2-yl acetate
CID 298868
2-Methyl-6-(trifluoromethyl)morpholin-3-one
CID 73994585
2-methoxy-N-[1-(2,2,2-trifluoroethoxy)propyl]propanamide
CID 10586295
2,2,2-trifluoro-N-(2-propan-2-yloxyethyl)acetamide
CID 84454250
N-[2-[(2R)-butan-2-yl]oxyethyl]acetamide
CID 129213429
2,2,2-trifluoro-N-(morpholin-2-ylmethyl)acetamide
CID 11550261
2,2,2-trifluoro-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 14511495
2,2,2-trifluoro-N-[(2S)-1-methoxypropan-2-yl]acetamide
CID 14511496
2,2,2-trifluoro-N-(morpholin-2-ylmethyl)acetamide;hydrochloride
CID 14839574

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxypropyl)-2,2-difluoroacetamide?
The IUPAC name of N-(2-ethoxypropyl)-2,2-difluoroacetamide (CID 103516048) is N-(2-ethoxypropyl)-2,2-difluoroacetamide.
What is the SMILES notation for N-(2-ethoxypropyl)-2,2-difluoroacetamide?
The canonical SMILES for N-(2-ethoxypropyl)-2,2-difluoroacetamide is CCOC(C)CNC(=O)C(F)F.
What is the InChIKey of N-(2-ethoxypropyl)-2,2-difluoroacetamide?
The InChIKey is VVGWULXZCIPCCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2NO2/c1-3-12-5(2)4-10-7(11)6(8)9/h5-6H,3-4H2,1-2H3,(H,10,11).
What are the key properties of N-(2-ethoxypropyl)-2,2-difluoroacetamide?
N-(2-ethoxypropyl)-2,2-difluoroacetamide has a molecular weight of 181.18 g/mol, XLogP of 0.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxypropyl)-2,2-difluoroacetamide is sourced from PubChem (CID 103516048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).