5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid

C10H11NO3S — CID 43474414

IUPAC5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid
SMILESO=C(CC1CC1)Nc1ccc(C(=O)O)s1
InChIInChI=1S/C10H11NO3S/c12-8(5-6-1-2-6)11-9-4-3-7(15-9)10(13)14/h3-4,6H,1-2,5H2,(H,11,12)(H,13,14)
InChIKeyUDCKQFZNPDSXBZ-UHFFFAOYSA-N
MW225.27 g/mol
LogP2.18
Rot. Bonds4

About 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid

5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid (PubChem CID 43474414) has the molecular formula C10H11NO3S and a molecular weight of 225.27 g/mol. Its IUPAC name is 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid.

Molecular Properties

Compound Name5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid
PubChem CID43474414
Molecular FormulaC10H11NO3S
Molecular Weight225.27 g/mol
Exact Mass225.05
IUPAC Name5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid
SMILESO=C(CC1CC1)Nc1ccc(C(=O)O)s1
InChIInChI=1S/C10H11NO3S/c12-8(5-6-1-2-6)11-9-4-3-7(15-9)10(13)14/h3-4,6H,1-2,5H2,(H,11,12)(H,13,14)
InChIKeyUDCKQFZNPDSXBZ-UHFFFAOYSA-N
XLogP2.18
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid 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

5-(cyclopent-3-ene-1-carbonylamino)thiophene-2-carboxylic acid
CID 64767352
2-cyclopropyl-N-phenylacetamide
CID 60753326
5-[[[2-(oxan-4-yl)acetyl]amino]methyl]thiophene-2-carboxylic acid
CID 122110815
5-[(2-propoxyacetyl)amino]thiophene-2-carboxylic acid
CID 107937745
5-[[(2R)-5-oxopyrrolidine-2-carbonyl]amino]thiophene-2-carboxylic acid
CID 93058416
5-(thiane-2-carbonylamino)thiophene-2-carboxylic acid
CID 80593515
5-[[(2S)-oxolane-2-carbonyl]amino]thiophene-2-carboxylic acid
CID 93058485
5-[[2-(4-nitrophenyl)acetyl]amino]thiophene-2-carboxylic acid
CID 43474780
5-[(2-cyclohexylacetyl)amino]-3-methylthiophene-2-carboxylic acid
CID 43209838
5-[[(4-hydroxycyclohexyl)methylamino]methyl]thiophene-2-carboxylic acid
CID 106137091
5-[3-(2-oxo-1-pyridinyl)propanoylamino]thiophene-2-carboxylic acid
CID 43474600
5-(3-pyrazol-1-ylpropanoylamino)thiophene-2-carboxylic acid
CID 43474717

Frequently Asked Questions

What is the IUPAC name of 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid?
The IUPAC name of 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid (CID 43474414) is 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid.
What is the SMILES notation for 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid?
The canonical SMILES for 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid is O=C(CC1CC1)Nc1ccc(C(=O)O)s1.
What is the InChIKey of 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid?
The InChIKey is UDCKQFZNPDSXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO3S/c12-8(5-6-1-2-6)11-9-4-3-7(15-9)10(13)14/h3-4,6H,1-2,5H2,(H,11,12)(H,13,14).
What are the key properties of 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid?
5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid has a molecular weight of 225.27 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-cyclopropylacetyl)amino]thiophene-2-carboxylic acid is sourced from PubChem (CID 43474414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).