4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide

C10H15NO3S — CID 115410128

IUPAC4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide
SMILESCOc1csc(C(=O)NOCC(C)C)c1
InChIInChI=1S/C10H15NO3S/c1-7(2)5-14-11-10(12)9-4-8(13-3)6-15-9/h4,6-7H,5H2,1-3H3,(H,11,12)
InChIKeyIYIXQNMHJLAHBW-UHFFFAOYSA-N
MW229.30 g/mol
LogP2.07
Rot. Bonds5

About 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide

4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide (PubChem CID 115410128) has the molecular formula C10H15NO3S and a molecular weight of 229.30 g/mol. Its IUPAC name is 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide
PubChem CID115410128
Molecular FormulaC10H15NO3S
Molecular Weight229.30 g/mol
Exact Mass229.08
IUPAC Name4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide
SMILESCOc1csc(C(=O)NOCC(C)C)c1
InChIInChI=1S/C10H15NO3S/c1-7(2)5-14-11-10(12)9-4-8(13-3)6-15-9/h4,6-7H,5H2,1-3H3,(H,11,12)
InChIKeyIYIXQNMHJLAHBW-UHFFFAOYSA-N
XLogP2.07
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-methoxy-N-(2-methylpropoxy)thiophene-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-(4-hydroxybutan-2-yl)-4-methoxythiophene-2-carboxamide
CID 115283653
N-(2-hydroxypropyl)-4-methoxythiophene-2-carboxamide
CID 81121281
N-(1-amino-3-methyl-1-oxopentan-2-yl)-4-methoxythiophene-2-carboxamide
CID 71865619
N-(1-iodo-3-methylbutan-2-yl)-4-methoxythiophene-2-carboxamide
CID 107860185
N-(2-amino-3-hydroxybutyl)-4-methoxythiophene-2-carboxamide
CID 81119658
N-(1-amino-3-methyl-1-sulfanylidenebutan-2-yl)-4-methoxythiophene-2-carboxamide
CID 81121736
N-(2-aminobutyl)-4-methoxythiophene-2-carboxamide
CID 81118589
N-(3-chlorobutyl)-4-methoxythiophene-2-carboxamide
CID 114301701
4-amino-2-[(4-methoxythiophene-2-carbonyl)amino]-4-oxobutanoic acid
CID 81117804
(2S)-2-[(4-methoxythiophene-2-carbonyl)amino]pentanoic acid
CID 107564238
4-methoxy-N-[2-(methylamino)ethyl]thiophene-2-carboxamide
CID 81122879
2-hydroxy-5-methoxy-N-(2-methylpropoxy)benzamide
CID 115410347

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide?
The IUPAC name of 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide (CID 115410128) is 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide is COc1csc(C(=O)NOCC(C)C)c1.
What is the InChIKey of 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide?
The InChIKey is IYIXQNMHJLAHBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3S/c1-7(2)5-14-11-10(12)9-4-8(13-3)6-15-9/h4,6-7H,5H2,1-3H3,(H,11,12).
What are the key properties of 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide?
4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide has a molecular weight of 229.30 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-methylpropoxy)thiophene-2-carboxamide is sourced from PubChem (CID 115410128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).