N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide

C11H21F3N2O2 — CID 47031323

IUPACN-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
SMILESCCN(CC)CCNC(=O)C(C)OCC(F)(F)F
InChIInChI=1S/C11H21F3N2O2/c1-4-16(5-2)7-6-15-10(17)9(3)18-8-11(12,13)14/h9H,4-8H2,1-3H3,(H,15,17)
InChIKeyXUQXYGWFZIPCCB-UHFFFAOYSA-N
MW270.30 g/mol
LogP1.41
Rot. Bonds8

About N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide

N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide (PubChem CID 47031323) has the molecular formula C11H21F3N2O2 and a molecular weight of 270.30 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
PubChem CID47031323
Molecular FormulaC11H21F3N2O2
Molecular Weight270.30 g/mol
Exact Mass270.16
IUPAC NameN-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
SMILESCCN(CC)CCNC(=O)C(C)OCC(F)(F)F
InChIInChI=1S/C11H21F3N2O2/c1-4-16(5-2)7-6-15-10(17)9(3)18-8-11(12,13)14/h9H,4-8H2,1-3H3,(H,15,17)
InChIKeyXUQXYGWFZIPCCB-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.30
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-Acetylpiperazin-1-yl)-2-(2,2,2-trifluoroethoxy)propan-1-one
CID 45887347
2-methyl-N-[2-[2-(2-methylpropoxy)propanoylamino]ethyl]propanamide
CID 47030971
N-[2-(dimethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide
CID 47031333
2-methyl-N-[2-[2-(2,2,2-trifluoroethoxy)propanoylamino]ethyl]propanamide
CID 47031355
N-(2-aminoethyl)-perfluoro-2-methyl-3-oxa-hexanamide
CID 134694480
2-methoxy-N-[2-[methyl(propan-2-yl)amino]ethyl]propanamide
CID 71934317
N-(2-aminoethyl)-2,2-difluoro-2-propoxyacetamide
CID 23379722
2-propan-2-yloxy-N-(2,2,2-trifluoroethyl)acetamide
CID 57832481
2,3,3,3-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)-N-[2-[2-[[3,3,3-trifluoro-2-(1,2,2,2-tetrafluoroethoxy)propanoyl]amino]ethoxy]ethyl]propanamide
CID 59157492
N-methyl-4-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 75501672
2-ethoxy-N'-(2,2,3,3,3-pentafluoropropyl)propanediamide
CID 89328849
N-[2-[bis(2-aminoethyl)amino]ethyl]-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propanamide
CID 89981350

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide (CID 47031323) is N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide is CCN(CC)CCNC(=O)C(C)OCC(F)(F)F.
What is the InChIKey of N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
The InChIKey is XUQXYGWFZIPCCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O2/c1-4-16(5-2)7-6-15-10(17)9(3)18-8-11(12,13)14/h9H,4-8H2,1-3H3,(H,15,17).
What are the key properties of N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide?
N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide has a molecular weight of 270.30 g/mol, XLogP of 1.41, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-2-(2,2,2-trifluoroethoxy)propanamide is sourced from PubChem (CID 47031323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).