5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide

C12H18N2O3S — CID 43572932

IUPAC5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)N(CCO)C(C)C)s1
InChIInChI=1S/C12H18N2O3S/c1-8(2)14(6-7-15)12(17)10-4-5-11(18-10)13-9(3)16/h4-5,8,15H,6-7H2,1-3H3,(H,13,16)
InChIKeyJFRJTTHLOLVKJO-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.55
Rot. Bonds5

About 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide

5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide (PubChem CID 43572932) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide
PubChem CID43572932
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)N(CCO)C(C)C)s1
InChIInChI=1S/C12H18N2O3S/c1-8(2)14(6-7-15)12(17)10-4-5-11(18-10)13-9(3)16/h4-5,8,15H,6-7H2,1-3H3,(H,13,16)
InChIKeyJFRJTTHLOLVKJO-UHFFFAOYSA-N
XLogP1.55
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylthiophene-2-carboxamide
CID 43573178
1-(2-hydroxyethyl)-3-(5-methylthiophen-2-yl)-1-propan-2-ylurea
CID 136529240
5-acetamido-N-(3-hydroxy-2-methylpropyl)thiophene-2-carboxamide
CID 65036927
5-acetamido-N-(4-hydroxy-3-methylbutan-2-yl)thiophene-2-carboxamide
CID 115770902
5-acetamido-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]thiophene-2-carboxamide
CID 79246233
5-acetamido-N-[[4-(hydroxymethyl)phenyl]methyl]thiophene-2-carboxamide
CID 107232601
5-acetamido-N-(6-hydroxyhexyl)thiophene-2-carboxamide
CID 103919192
5-acetamido-N-(1-hydroxy-3-methylbutan-2-yl)thiophene-2-carboxamide
CID 79252074
methyl 2-[(5-acetamidothiophene-2-carbonyl)-methylamino]acetate
CID 43409771
N-[(4-cyanophenyl)methyl]-5-(phenylcarbamoylamino)-N-propan-2-ylthiophene-2-carboxamide
CID 78853392
4-[(5-acetamidothiophene-2-carbonyl)amino]-3-methylbutanoic acid
CID 81064594
2-(4-acetamidophenyl)-N-(2-hydroxyethyl)-N-propan-2-ylacetamide
CID 43572893

Frequently Asked Questions

What is the IUPAC name of 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide?
The IUPAC name of 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide (CID 43572932) is 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide.
What is the SMILES notation for 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide?
The canonical SMILES for 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide is CC(=O)Nc1ccc(C(=O)N(CCO)C(C)C)s1.
What is the InChIKey of 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide?
The InChIKey is JFRJTTHLOLVKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-8(2)14(6-7-15)12(17)10-4-5-11(18-10)13-9(3)16/h4-5,8,15H,6-7H2,1-3H3,(H,13,16).
What are the key properties of 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide?
5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide has a molecular weight of 270.35 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-N-(2-hydroxyethyl)-N-propan-2-ylthiophene-2-carboxamide is sourced from PubChem (CID 43572932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).