N-(2-ethylhexyl)-2-thiophen-2-ylacetamide

C14H23NOS — CID 2916095

IUPACN-(2-ethylhexyl)-2-thiophen-2-ylacetamide
SMILESCCCCC(CC)CNC(=O)Cc1cccs1
InChIInChI=1S/C14H23NOS/c1-3-5-7-12(4-2)11-15-14(16)10-13-8-6-9-17-13/h6,8-9,12H,3-5,7,10-11H2,1-2H3,(H,15,16)
InChIKeyNFHCBWIMPRHLFX-UHFFFAOYSA-N
MW253.41 g/mol
LogP3.62
Rot. Bonds8

About N-(2-ethylhexyl)-2-thiophen-2-ylacetamide

N-(2-ethylhexyl)-2-thiophen-2-ylacetamide (PubChem CID 2916095) has the molecular formula C14H23NOS and a molecular weight of 253.41 g/mol. Its IUPAC name is N-(2-ethylhexyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-ethylhexyl)-2-thiophen-2-ylacetamide
PubChem CID2916095
Molecular FormulaC14H23NOS
Molecular Weight253.41 g/mol
Exact Mass253.15
IUPAC NameN-(2-ethylhexyl)-2-thiophen-2-ylacetamide
SMILESCCCCC(CC)CNC(=O)Cc1cccs1
InChIInChI=1S/C14H23NOS/c1-3-5-7-12(4-2)11-15-14(16)10-13-8-6-9-17-13/h6,8-9,12H,3-5,7,10-11H2,1-2H3,(H,15,16)
InChIKeyNFHCBWIMPRHLFX-UHFFFAOYSA-N
XLogP3.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.41
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2S)-2-ethylhexyl]-3-(thiophene-2-carbonylamino)thiourea
CID 135779686
N-[(2R)-2-ethylhexyl]-2-naphthalen-1-ylacetamide
CID 7314092
2-thiophen-2-yl-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]acetamide
CID 25146649
N-[2-(methylamino)propyl]-2-thiophen-2-ylacetamide;hydrochloride
CID 120827269
N-(2-ethylhexyl)-3-phenylpropanamide
CID 3261802
methyl 2-bromo-3-[(2-thiophen-2-ylacetyl)amino]propanoate
CID 103492522
2-(2-ethylhexylcarbamoyl)thiophene-3-carboxylic acid
CID 135271179
N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-thiophen-2-ylacetamide
CID 112995358
N-[(2R)-2-ethylhexyl]-2-(4-nitrophenyl)acetamide
CID 40579389
2-thiophen-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 1245174
N-(2-ethylhexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 134057702
N-(2-ethylhexyl)-2-hydroxybenzamide
CID 66524068

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylhexyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(2-ethylhexyl)-2-thiophen-2-ylacetamide (CID 2916095) is N-(2-ethylhexyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(2-ethylhexyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(2-ethylhexyl)-2-thiophen-2-ylacetamide is CCCCC(CC)CNC(=O)Cc1cccs1.
What is the InChIKey of N-(2-ethylhexyl)-2-thiophen-2-ylacetamide?
The InChIKey is NFHCBWIMPRHLFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NOS/c1-3-5-7-12(4-2)11-15-14(16)10-13-8-6-9-17-13/h6,8-9,12H,3-5,7,10-11H2,1-2H3,(H,15,16).
What are the key properties of N-(2-ethylhexyl)-2-thiophen-2-ylacetamide?
N-(2-ethylhexyl)-2-thiophen-2-ylacetamide has a molecular weight of 253.41 g/mol, XLogP of 3.62, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylhexyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 2916095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).