2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide

C10H13F2NO2S — CID 103514732

IUPAC2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide
SMILESCOCCN(Cc1cccs1)C(=O)C(F)F
InChIInChI=1S/C10H13F2NO2S/c1-15-5-4-13(10(14)9(11)12)7-8-3-2-6-16-8/h2-3,6,9H,4-5,7H2,1H3
InChIKeyXQCYJQBQBDASFU-UHFFFAOYSA-N
MW249.28 g/mol
LogP1.99
Rot. Bonds6

About 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide

2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 103514732) has the molecular formula C10H13F2NO2S and a molecular weight of 249.28 g/mol. Its IUPAC name is 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID103514732
Molecular FormulaC10H13F2NO2S
Molecular Weight249.28 g/mol
Exact Mass249.06
IUPAC Name2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide
SMILESCOCCN(Cc1cccs1)C(=O)C(F)F
InChIInChI=1S/C10H13F2NO2S/c1-15-5-4-13(10(14)9(11)12)7-8-3-2-6-16-8/h2-3,6,9H,4-5,7H2,1H3
InChIKeyXQCYJQBQBDASFU-UHFFFAOYSA-N
XLogP1.99
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.28
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,2-trifluoro-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide
CID 5177104
N-[1-(hydroxymethyl)propyl]-2-(methylthio)-N-(2-thienylmethyl)acetamide
CID 46997059
2-((4-fluorophenyl)thio)-N-(2-methoxyethyl)-N-(thiophen-3-ylmethyl)acetamide
CID 49676622
N-(2-methoxyethyl)-1-methyl-6-oxo-N-(2-thienylmethyl)-1,6-dihydropyridine-3-carboxamide
CID 50961651
2,2-Difluoro-1-morpholin-4-yl-2-thiophen-2-ylethanone
CID 134861849
2,2-Difluoro-1-morpholin-4-yl-4-thiophen-2-ylbut-3-yn-1-one
CID 164668537
2-methoxy-N-methyl-N-(1-thiophen-2-ylethyl)acetamide
CID 51074235
1-ethyl-5-{[(2-methoxyethyl)(2-thienylmethyl)amino]methyl}-2(1H)-pyridinone
CID 53191757
N-methyl-N-(1-thiophen-2-ylethyl)acetamide
CID 60698565
2,2,2-trifluoroethyl N-[(thiophen-2-yl)methyl]carbamate
CID 9450078
3,3,3-trifluoro-N-(thiophen-2-ylmethyl)propanamide
CID 45808089
N-(1-thiophen-2-ylethyl)-2-(2,2,2-trifluoroethoxy)propanamide
CID 45887448

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide (CID 103514732) is 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide is COCCN(Cc1cccs1)C(=O)C(F)F.
What is the InChIKey of 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is XQCYJQBQBDASFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2NO2S/c1-15-5-4-13(10(14)9(11)12)7-8-3-2-6-16-8/h2-3,6,9H,4-5,7H2,1H3.
What are the key properties of 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide?
2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 249.28 g/mol, XLogP of 1.99, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 103514732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).