N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide

C10H18F3NO2 — CID 170040616

IUPACN-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide
SMILESCCN(CC(C)OC(C)C)C(=O)C(F)(F)F
InChIInChI=1S/C10H18F3NO2/c1-5-14(9(15)10(11,12)13)6-8(4)16-7(2)3/h7-8H,5-6H2,1-4H3
InChIKeyJLPAAYGMBWRLCE-UHFFFAOYSA-N
MW241.25 g/mol
LogP2.21
Rot. Bonds5

About N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide

N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide (PubChem CID 170040616) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide
PubChem CID170040616
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC NameN-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide
SMILESCCN(CC(C)OC(C)C)C(=O)C(F)(F)F
InChIInChI=1S/C10H18F3NO2/c1-5-14(9(15)10(11,12)13)6-8(4)16-7(2)3/h7-8H,5-6H2,1-4H3
InChIKeyJLPAAYGMBWRLCE-UHFFFAOYSA-N
XLogP2.21
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide?
The IUPAC name of N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide (CID 170040616) is N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide.
What is the SMILES notation for N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide?
The canonical SMILES for N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide is CCN(CC(C)OC(C)C)C(=O)C(F)(F)F.
What is the InChIKey of N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide?
The InChIKey is JLPAAYGMBWRLCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c1-5-14(9(15)10(11,12)13)6-8(4)16-7(2)3/h7-8H,5-6H2,1-4H3.
What are the key properties of N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide?
N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide has a molecular weight of 241.25 g/mol, XLogP of 2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2,2-trifluoro-N-(2-propan-2-yloxypropyl)acetamide is sourced from PubChem (CID 170040616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).