2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide

C13H22N2O2S — CID 111441786

IUPAC2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide
SMILESCCN(CC)CC(=O)NCC(C)(O)c1cccs1
InChIInChI=1S/C13H22N2O2S/c1-4-15(5-2)9-12(16)14-10-13(3,17)11-7-6-8-18-11/h6-8,17H,4-5,9-10H2,1-3H3,(H,14,16)
InChIKeyMFEZKVSTYSLJLJ-UHFFFAOYSA-N
MW270.40 g/mol
LogP1.41
Rot. Bonds7

About 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide

2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide (PubChem CID 111441786) has the molecular formula C13H22N2O2S and a molecular weight of 270.40 g/mol. Its IUPAC name is 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide
PubChem CID111441786
Molecular FormulaC13H22N2O2S
Molecular Weight270.40 g/mol
Exact Mass270.14
IUPAC Name2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide
SMILESCCN(CC)CC(=O)NCC(C)(O)c1cccs1
InChIInChI=1S/C13H22N2O2S/c1-4-15(5-2)9-12(16)14-10-13(3,17)11-7-6-8-18-11/h6-8,17H,4-5,9-10H2,1-3H3,(H,14,16)
InChIKeyMFEZKVSTYSLJLJ-UHFFFAOYSA-N
XLogP1.41
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.40
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-2-thiophen-2-ylpropyl)pentanamide
CID 90499744
N-(2-hydroxy-2-thiophen-2-ylpropyl)-2,2-dimethylpropanamide
CID 71782337
methyl N-(2-hydroxy-2-thiophen-2-ylpropyl)carbamate
CID 90499737
3-(2-hydroxyphenyl)-N-(2-hydroxy-2-thiophen-2-ylpropyl)propanamide
CID 111442061
1-[2-(dimethylamino)-2-methylpropyl]-3-(2-hydroxy-2-thiophen-2-ylpropyl)urea
CID 111443503
N-(2-hydroxy-2-thiophen-2-ylpropyl)-3-phenylbutanamide
CID 111442221
2-(dimethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)-3-methylbutanamide
CID 111442311
N-(2-hydroxy-2-thiophen-2-ylpropyl)-4-methylcyclohexane-1-carboxamide
CID 111478212
2-(4-fluorophenoxy)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide
CID 90499789
N-[(2S)-2-hydroxy-2-thiophen-2-ylpropyl]thiophene-3-carboxamide
CID 95983240
2,6-difluoro-N-[(2S)-2-hydroxy-2-thiophen-2-ylpropyl]benzamide
CID 95983276
(E)-4-(dimethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)but-2-enamide
CID 146101049

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide?
The IUPAC name of 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide (CID 111441786) is 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide.
What is the SMILES notation for 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide?
The canonical SMILES for 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide is CCN(CC)CC(=O)NCC(C)(O)c1cccs1.
What is the InChIKey of 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide?
The InChIKey is MFEZKVSTYSLJLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2S/c1-4-15(5-2)9-12(16)14-10-13(3,17)11-7-6-8-18-11/h6-8,17H,4-5,9-10H2,1-3H3,(H,14,16).
What are the key properties of 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide?
2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide has a molecular weight of 270.40 g/mol, XLogP of 1.41, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-(2-hydroxy-2-thiophen-2-ylpropyl)acetamide is sourced from PubChem (CID 111441786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).