4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one

C8H6N2O2S — CID 15567545

IUPAC4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)c1cccs1
InChIInChI=1S/C8H6N2O2S/c11-7(6-2-1-3-13-6)5-4-9-8(12)10-5/h1-4H,(H2,9,10,12)
InChIKeyHTZQRQHUGJZVNG-UHFFFAOYSA-N
MW194.22 g/mol
LogP1.00
Rot. Bonds2

About 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one

4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one (PubChem CID 15567545) has the molecular formula C8H6N2O2S and a molecular weight of 194.22 g/mol. Its IUPAC name is 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
PubChem CID15567545
Molecular FormulaC8H6N2O2S
Molecular Weight194.22 g/mol
Exact Mass194.01
IUPAC Name4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
SMILESO=C(c1c[nH]c(=O)[nH]1)c1cccs1
InChIInChI=1S/C8H6N2O2S/c11-7(6-2-1-3-13-6)5-4-9-8(12)10-5/h1-4H,(H2,9,10,12)
InChIKeyHTZQRQHUGJZVNG-UHFFFAOYSA-N
XLogP1.00
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.22
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one 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 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one (CID 15567545) is 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one is O=C(c1c[nH]c(=O)[nH]1)c1cccs1.
What is the InChIKey of 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The InChIKey is HTZQRQHUGJZVNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O2S/c11-7(6-2-1-3-13-6)5-4-9-8(12)10-5/h1-4H,(H2,9,10,12).
What are the key properties of 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one has a molecular weight of 194.22 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 15567545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).