N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide

C11H14F3NOS — CID 78858748

IUPACN-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCN(CC(F)(F)F)C(=O)CCc1cccs1
InChIInChI=1S/C11H14F3NOS/c1-2-15(8-11(12,13)14)10(16)6-5-9-4-3-7-17-9/h3-4,7H,2,5-6,8H2,1H3
InChIKeyMUNMHOYJDFILFF-UHFFFAOYSA-N
MW265.30 g/mol
LogP3.09
Rot. Bonds5

About N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide

N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 78858748) has the molecular formula C11H14F3NOS and a molecular weight of 265.30 g/mol. Its IUPAC name is N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID78858748
Molecular FormulaC11H14F3NOS
Molecular Weight265.30 g/mol
Exact Mass265.07
IUPAC NameN-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCCN(CC(F)(F)F)C(=O)CCc1cccs1
InChIInChI=1S/C11H14F3NOS/c1-2-15(8-11(12,13)14)10(16)6-5-9-4-3-7-17-9/h3-4,7H,2,5-6,8H2,1H3
InChIKeyMUNMHOYJDFILFF-UHFFFAOYSA-N
XLogP3.09
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.30
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-butyl-N-ethyl-2-(2-thienyl)acetamide
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Thiophene,2-(N,N-diMe acetamido)
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2-Thiopheneacetamide, N,N-dibutyl-
CID 532844
N-butyl-2-thiophen-2-ylacetamide
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2-Thiopheneacetamide, N-pentyl-
CID 2445132
1-[7-(Thiophen-2-yl)-1,4-thiazepan-4-yl]ethan-1-one
CID 90632626
1-Pyrrolidin-1-yl-7-thiophen-2-ylheptan-1-one
CID 155523085
N,N-dipropyl-2-(2-thienyl)acetamide
CID 670016
N,N-diethyl-2-(2-thienyl)acetamide
CID 669955
1-(Azepan-1-yl)-2-thiophen-2-ylethanone
CID 4529068

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide (CID 78858748) is N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide is CCN(CC(F)(F)F)C(=O)CCc1cccs1.
What is the InChIKey of N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is MUNMHOYJDFILFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3NOS/c1-2-15(8-11(12,13)14)10(16)6-5-9-4-3-7-17-9/h3-4,7H,2,5-6,8H2,1H3.
What are the key properties of N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide?
N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 265.30 g/mol, XLogP of 3.09, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-thiophen-2-yl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 78858748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).