N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide

C11H17NO2S — CID 3668870

IUPACN-(3-ethoxypropyl)-2-thiophen-2-ylacetamide
SMILESCCOCCCNC(=O)Cc1cccs1
InChIInChI=1S/C11H17NO2S/c1-2-14-7-4-6-12-11(13)9-10-5-3-8-15-10/h3,5,8H,2,4,6-7,9H2,1H3,(H,12,13)
InChIKeyLYESDRGMTIJRES-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.83
Rot. Bonds7

About N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide

N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide (PubChem CID 3668870) has the molecular formula C11H17NO2S and a molecular weight of 227.33 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-2-thiophen-2-ylacetamide
PubChem CID3668870
Molecular FormulaC11H17NO2S
Molecular Weight227.33 g/mol
Exact Mass227.10
IUPAC NameN-(3-ethoxypropyl)-2-thiophen-2-ylacetamide
SMILESCCOCCCNC(=O)Cc1cccs1
InChIInChI=1S/C11H17NO2S/c1-2-14-7-4-6-12-11(13)9-10-5-3-8-15-10/h3,5,8H,2,4,6-7,9H2,1H3,(H,12,13)
InChIKeyLYESDRGMTIJRES-UHFFFAOYSA-N
XLogP1.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-2-Thiophen-2-Yl-Acetamide Boronic Acid
CID 2671
Acetamide, N-tetrahydrofurfuryl-2-(2-thienyl)-
CID 531782
N-(3-methoxypropyl)thiophene-2-carboxamide
CID 2057652
N-(3-ethoxypropyl)thiophene-2-carboxamide
CID 2180987
N-(3-isopropoxypropyl)-2-thiophenecarboxamide
CID 2212554
N-(3-butoxypropyl)thiophene-2-carboxamide
CID 2287726
Icosa-5,8,11,14-tetraenoic acid (thiophen-2-ylmethyl)-amide
CID 10272277
(5Z,8Z,11Z,14Z)-N-(1-thiophen-2-ylpropan-2-yl)icosa-5,8,11,14-tetraenamide
CID 10928080
Icosa-5,8,11,14-tetraenoic acid (2-thiophen-2-yl-ethyl)-amide
CID 10949701
2-[2-[(2-Thiophen-2-ylacetyl)amino]acetyl]sulfanylacetic acid
CID 122180360
2-[(2S)-4-methylsulfanyl-2-[(2-thiophen-2-ylacetyl)amino]butanoyl]sulfanylacetic acid
CID 122180364
N-[2-(2-thienyl)ethyl]cyclopropanecarboxamide
CID 2739306

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide (CID 3668870) is N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide is CCOCCCNC(=O)Cc1cccs1.
What is the InChIKey of N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide?
The InChIKey is LYESDRGMTIJRES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2S/c1-2-14-7-4-6-12-11(13)9-10-5-3-8-15-10/h3,5,8H,2,4,6-7,9H2,1H3,(H,12,13).
What are the key properties of N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide?
N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide has a molecular weight of 227.33 g/mol, XLogP of 1.83, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 3668870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).