4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one

C10H10N2O2S — CID 15567547

IUPAC4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
SMILESCCc1[nH]c(=O)[nH]c1C(=O)c1cccs1
InChIInChI=1S/C10H10N2O2S/c1-2-6-8(12-10(14)11-6)9(13)7-4-3-5-15-7/h3-5H,2H2,1H3,(H2,11,12,14)
InChIKeyUXWWGQMQVPSDDF-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.56
Rot. Bonds3

About 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one

4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one (PubChem CID 15567547) has the molecular formula C10H10N2O2S and a molecular weight of 222.27 g/mol. Its IUPAC name is 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
PubChem CID15567547
Molecular FormulaC10H10N2O2S
Molecular Weight222.27 g/mol
Exact Mass222.05
IUPAC Name4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
SMILESCCc1[nH]c(=O)[nH]c1C(=O)c1cccs1
InChIInChI=1S/C10H10N2O2S/c1-2-6-8(12-10(14)11-6)9(13)7-4-3-5-15-7/h3-5H,2H2,1H3,(H2,11,12,14)
InChIKeyUXWWGQMQVPSDDF-UHFFFAOYSA-N
XLogP1.56
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one (CID 15567547) is 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one is CCc1[nH]c(=O)[nH]c1C(=O)c1cccs1.
What is the InChIKey of 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The InChIKey is UXWWGQMQVPSDDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S/c1-2-6-8(12-10(14)11-6)9(13)7-4-3-5-15-7/h3-5H,2H2,1H3,(H2,11,12,14).
What are the key properties of 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one has a molecular weight of 222.27 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 15567547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).