2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide

C10H13F2NOS — CID 103515707

IUPAC2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
SMILESCCCC(NC(=O)C(F)F)c1cccs1
InChIInChI=1S/C10H13F2NOS/c1-2-4-7(8-5-3-6-15-8)13-10(14)9(11)12/h3,5-7,9H,2,4H2,1H3,(H,13,14)
InChIKeyBFXXLPPFNYJEGA-UHFFFAOYSA-N
MW233.28 g/mol
LogP2.97
Rot. Bonds5

About 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide

2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide (PubChem CID 103515707) has the molecular formula C10H13F2NOS and a molecular weight of 233.28 g/mol. Its IUPAC name is 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
PubChem CID103515707
Molecular FormulaC10H13F2NOS
Molecular Weight233.28 g/mol
Exact Mass233.07
IUPAC Name2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
SMILESCCCC(NC(=O)C(F)F)c1cccs1
InChIInChI=1S/C10H13F2NOS/c1-2-4-7(8-5-3-6-15-8)13-10(14)9(11)12/h3,5-7,9H,2,4H2,1H3,(H,13,14)
InChIKeyBFXXLPPFNYJEGA-UHFFFAOYSA-N
XLogP2.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(1-thiophen-2-ylbutyl)propanamide
CID 107904985
2-methyl-3-(methylamino)-N-(1-thiophen-2-ylbutyl)propanamide
CID 79203080
2-(aminomethyl)-N-(1-thiophen-2-ylbutyl)butanamide
CID 65229248
3-oxo-3-(1-thiophen-2-ylbutylamino)propanoic acid
CID 62231148
5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide
CID 104684884
(2R)-2-amino-3-phenyl-N-(1-thiophen-2-ylbutyl)propanamide
CID 78984626
3-amino-3-sulfanylidene-N-(1-thiophen-2-ylbutyl)propanamide
CID 55134581
N-[(1S)-1-thiophen-2-ylbutyl]hydroxylamine
CID 131230047
2-amino-5-methoxy-N-(1-thiophen-2-ylbutyl)pentanamide
CID 81087987
2-fluoro-6-hydroxy-N-(1-thiophen-2-ylbutyl)benzamide
CID 104917044
2-bromo-5-fluoro-N-(1-thiophen-2-ylbutyl)benzamide
CID 61381188
4-(methylamino)-N-(1-thiophen-2-ylbutyl)benzamide
CID 62173495

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide?
The IUPAC name of 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide (CID 103515707) is 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide.
What is the SMILES notation for 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide?
The canonical SMILES for 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide is CCCC(NC(=O)C(F)F)c1cccs1.
What is the InChIKey of 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide?
The InChIKey is BFXXLPPFNYJEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2NOS/c1-2-4-7(8-5-3-6-15-8)13-10(14)9(11)12/h3,5-7,9H,2,4H2,1H3,(H,13,14).
What are the key properties of 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide?
2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide has a molecular weight of 233.28 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide is sourced from PubChem (CID 103515707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).