(5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol

C9H11NO2S — CID 131860282

IUPAC(5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol
SMILESCON=C1c2sccc2C[C@@]1(C)O
InChIInChI=1S/C9H11NO2S/c1-9(11)5-6-3-4-13-7(6)8(9)10-12-2/h3-4,11H,5H2,1-2H3/t9-/m1/s1
InChIKeyYSKBKUOIIUAPJA-SECBINFHSA-N
MW197.26 g/mol
LogP1.41
Rot. Bonds1

About (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol

(5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol (PubChem CID 131860282) has the molecular formula C9H11NO2S and a molecular weight of 197.26 g/mol. Its IUPAC name is (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol.

Molecular Properties

Compound Name(5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol
PubChem CID131860282
Molecular FormulaC9H11NO2S
Molecular Weight197.26 g/mol
Exact Mass197.05
IUPAC Name(5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol
SMILESCON=C1c2sccc2C[C@@]1(C)O
InChIInChI=1S/C9H11NO2S/c1-9(11)5-6-3-4-13-7(6)8(9)10-12-2/h3-4,11H,5H2,1-2H3/t9-/m1/s1
InChIKeyYSKBKUOIIUAPJA-SECBINFHSA-N
XLogP1.41
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol?
The IUPAC name of (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol (CID 131860282) is (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol.
What is the SMILES notation for (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol?
The canonical SMILES for (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol is CON=C1c2sccc2C[C@@]1(C)O.
What is the InChIKey of (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol?
The InChIKey is YSKBKUOIIUAPJA-SECBINFHSA-N. The full InChI is InChI=1S/C9H11NO2S/c1-9(11)5-6-3-4-13-7(6)8(9)10-12-2/h3-4,11H,5H2,1-2H3/t9-/m1/s1.
What are the key properties of (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol?
(5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol has a molecular weight of 197.26 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-6-methoxyimino-5-methyl-4H-cyclopenta[b]thiophen-5-ol is sourced from PubChem (CID 131860282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).