N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide

C15H17NO2S — CID 60653994

IUPACN-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide
SMILESO=C(Cc1ccsc1)N(CCO)Cc1ccccc1
InChIInChI=1S/C15H17NO2S/c17-8-7-16(11-13-4-2-1-3-5-13)15(18)10-14-6-9-19-12-14/h1-6,9,12,17H,7-8,10-11H2
InChIKeyHUCIYHKXEDWCFC-UHFFFAOYSA-N
MW275.37 g/mol
LogP2.31
Rot. Bonds6

About N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide

N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide (PubChem CID 60653994) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide
PubChem CID60653994
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC NameN-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide
SMILESO=C(Cc1ccsc1)N(CCO)Cc1ccccc1
InChIInChI=1S/C15H17NO2S/c17-8-7-16(11-13-4-2-1-3-5-13)15(18)10-14-6-9-19-12-14/h1-6,9,12,17H,7-8,10-11H2
InChIKeyHUCIYHKXEDWCFC-UHFFFAOYSA-N
XLogP2.31
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyethyl)-N-[(E)-3-phenylprop-2-enyl]-2-thiophen-3-ylacetamide
CID 50962725
N-(2-aminoethyl)-N-(2-phenylethyl)-2-thiophen-3-ylacetamide
CID 120885888
N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide
CID 62689181
N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
CID 60654052
N,N-diethyl-2-thiophen-3-ylacetamide
CID 60635955
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
N-benzyl-5-hydroxy-N-(2-hydroxyethyl)pentanamide
CID 79191990
N-benzyl-N-(2-hydroxyethyl)-2-(methylamino)acetamide
CID 58786294
6-[benzyl(2-hydroxyethyl)amino]-6-oxohexanoic acid
CID 60948107
N-(2-hydroxyethyl)-N-(2-phenylethyl)thiophene-3-carboxamide
CID 111122178
N-(2-hydroxyethyl)-1-phenyl-N-(thiophen-3-ylmethyl)methanesulfonamide
CID 75421892
N-[2-(2,4-dichlorophenyl)ethyl]-N-[(4-hydroxyphenyl)methyl]-2-thiophen-3-ylacetamide
CID 57456389

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide?
The IUPAC name of N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide (CID 60653994) is N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide?
The canonical SMILES for N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide is O=C(Cc1ccsc1)N(CCO)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide?
The InChIKey is HUCIYHKXEDWCFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S/c17-8-7-16(11-13-4-2-1-3-5-13)15(18)10-14-6-9-19-12-14/h1-6,9,12,17H,7-8,10-11H2.
What are the key properties of N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide?
N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide has a molecular weight of 275.37 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide is sourced from PubChem (CID 60653994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).