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

C9H8N2O2S — CID 15567546

IUPAC4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
SMILESCc1[nH]c(=O)[nH]c1C(=O)c1cccs1
InChIInChI=1S/C9H8N2O2S/c1-5-7(11-9(13)10-5)8(12)6-3-2-4-14-6/h2-4H,1H3,(H2,10,11,13)
InChIKeyMPJYFWDFBPZWQF-UHFFFAOYSA-N
MW208.24 g/mol
LogP1.30
Rot. Bonds2

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

4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one (PubChem CID 15567546) has the molecular formula C9H8N2O2S and a molecular weight of 208.24 g/mol. Its IUPAC name is 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
PubChem CID15567546
Molecular FormulaC9H8N2O2S
Molecular Weight208.24 g/mol
Exact Mass208.03
IUPAC Name4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
SMILESCc1[nH]c(=O)[nH]c1C(=O)c1cccs1
InChIInChI=1S/C9H8N2O2S/c1-5-7(11-9(13)10-5)8(12)6-3-2-4-14-6/h2-4H,1H3,(H2,10,11,13)
InChIKeyMPJYFWDFBPZWQF-UHFFFAOYSA-N
XLogP1.30
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dihydroxy-6-methyl-5-pyrimidinyl)-2-thiophenecarboxamide
CID 851472
1,3-Dihydro-4-(2-thienoyl)-2H-imidazol-2-one
CID 15567545
4-Ethyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one
CID 15567547
1-Cyclopentyl-3-(2-oxo-2-thiophen-2-ylethyl)urea
CID 8105667
Thenoyl-diaminoethane
CID 129739282
1-(2-Oxo-2-thiophen-2-ylethyl)pyrimidine-2,4-dione
CID 296429
(2-Sulfanylidene-1,3-dihydroimidazol-4-yl)-thiophen-2-ylmethanone
CID 20065774
(5-Methyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-thiophen-2-ylmethanone
CID 20065780
[5-(2-Methylpropyl)-2-sulfanylidene-1,3-dihydroimidazol-4-yl]-thiophen-2-ylmethanone
CID 20065797
5-(5-Ethyl-2-oxo-1,3-dihydroimidazole-4-carbonyl)thiophene-2-carbonitrile
CID 20259017
4-[(5-Cyano-2-thienyl)carbonyl]-5-methyl-1,3-dihydro-2H-imidazol-2-one
CID 20259029
4-[(5-bromo-2-thienyl)carbonyl]-5-methyl-1,3-dihydro-2H-imidazol-2-one
CID 20259032

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one (CID 15567546) is 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one is Cc1[nH]c(=O)[nH]c1C(=O)c1cccs1.
What is the InChIKey of 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
The InChIKey is MPJYFWDFBPZWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2S/c1-5-7(11-9(13)10-5)8(12)6-3-2-4-14-6/h2-4H,1H3,(H2,10,11,13).
What are the key properties of 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one?
4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one has a molecular weight of 208.24 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(thiophene-2-carbonyl)-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 15567546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).