N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide

C9H10F3NOS — CID 62733548

IUPACN-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide
SMILESCCN(Cc1cccs1)C(=O)C(F)(F)F
InChIInChI=1S/C9H10F3NOS/c1-2-13(8(14)9(10,11)12)6-7-4-3-5-15-7/h3-5H,2,6H2,1H3
InChIKeyDFEDHYGINVJJJA-UHFFFAOYSA-N
MW237.25 g/mol
LogP2.66
Rot. Bonds3

About N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide

N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 62733548) has the molecular formula C9H10F3NOS and a molecular weight of 237.25 g/mol. Its IUPAC name is N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide
PubChem CID62733548
Molecular FormulaC9H10F3NOS
Molecular Weight237.25 g/mol
Exact Mass237.04
IUPAC NameN-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide
SMILESCCN(Cc1cccs1)C(=O)C(F)(F)F
InChIInChI=1S/C9H10F3NOS/c1-2-13(8(14)9(10,11)12)6-7-4-3-5-15-7/h3-5H,2,6H2,1H3
InChIKeyDFEDHYGINVJJJA-UHFFFAOYSA-N
XLogP2.66
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(thiophen-2-yl)methyl]acetamide
CID 30617
N,2,2-trimethyl-N-[(5-methylthiophen-2-yl)methyl]butanamide
CID 60236671
N,2,2-trimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 121446738
2-Sulfanylidene-3-(thiophen-2-ylmethyl)-1,3-thiazolidin-4-one
CID 233540
Cyto9G3
CID 2732031
N,2,2-trimethyl-N-[(3-methylthiophen-2-yl)methyl]butanamide
CID 121446760
2-chloro-N-methyl-N-(thien-2-ylmethyl)acetamide
CID 2543182
(E)-N,N-diethyl-3-thiophen-2-ylprop-2-enamide
CID 2313985
Thiophene-2-carboxamide, N-ethyl-N-butyl-
CID 2164665
N,N-diethylthiophene-2-carboxamide
CID 962897
N-[(thiophen-2-yl)methyl]butanamide
CID 4117885
N,N-diethyl-2-(2-thienyl)acetamide
CID 669955

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide (CID 62733548) is N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide is CCN(Cc1cccs1)C(=O)C(F)(F)F.
What is the InChIKey of N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is DFEDHYGINVJJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F3NOS/c1-2-13(8(14)9(10,11)12)6-7-4-3-5-15-7/h3-5H,2,6H2,1H3.
What are the key properties of N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide?
N-ethyl-2,2,2-trifluoro-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 237.25 g/mol, XLogP of 2.66, 3 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-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 62733548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).