5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one

C14H21N3OS — CID 83255677

IUPAC5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
SMILESCC1NC(c2ccsc2)N(C2CCCN(C)C2)C1=O
InChIInChI=1S/C14H21N3OS/c1-10-14(18)17(12-4-3-6-16(2)8-12)13(15-10)11-5-7-19-9-11/h5,7,9-10,12-13,15H,3-4,6,8H2,1-2H3
InChIKeyDWWNASKMIARVSW-UHFFFAOYSA-N
MW279.41 g/mol
LogP1.66
Rot. Bonds2

About 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one

5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83255677) has the molecular formula C14H21N3OS and a molecular weight of 279.41 g/mol. Its IUPAC name is 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83255677
Molecular FormulaC14H21N3OS
Molecular Weight279.41 g/mol
Exact Mass279.14
IUPAC Name5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
SMILESCC1NC(c2ccsc2)N(C2CCCN(C)C2)C1=O
InChIInChI=1S/C14H21N3OS/c1-10-14(18)17(12-4-3-6-16(2)8-12)13(15-10)11-5-7-19-9-11/h5,7,9-10,12-13,15H,3-4,6,8H2,1-2H3
InChIKeyDWWNASKMIARVSW-UHFFFAOYSA-N
XLogP1.66
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-3-(1-methylpiperidin-4-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83243425
3-(1,3-dimethylpiperidin-4-yl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
CID 114506900
5-(2-methylpropyl)-3-(1-methylpyrrolidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83252600
5-methyl-3-(1-methylpyrrolidin-3-yl)-2-thiophen-2-ylimidazolidin-4-one
CID 83249925
3,5-dimethyl-2-thiophen-3-ylimidazolidin-4-one
CID 83260781
5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]-2-thiophen-3-ylimidazolidin-4-one
CID 114517110
2-(4-methoxyphenyl)-5-methyl-3-(1-methylpyrrolidin-3-yl)imidazolidin-4-one
CID 83252581
2-(3,4-difluorophenyl)-5-methyl-3-(1-methylpyrrolidin-3-yl)imidazolidin-4-one
CID 83252608
5-methyl-3-(2-pyrrolidin-1-ylethyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83251904
5-butan-2-yl-3-cyclobutyl-2-thiophen-3-ylimidazolidin-4-one
CID 83255478
3-(3-ethyl-2-methylcyclopentyl)-5-methyl-2-thiophen-3-ylimidazolidin-4-one
CID 83259456
5-butyl-3-cyclopentyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242915

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one (CID 83255677) is 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one is CC1NC(c2ccsc2)N(C2CCCN(C)C2)C1=O.
What is the InChIKey of 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is DWWNASKMIARVSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3OS/c1-10-14(18)17(12-4-3-6-16(2)8-12)13(15-10)11-5-7-19-9-11/h5,7,9-10,12-13,15H,3-4,6,8H2,1-2H3.
What are the key properties of 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one?
5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 279.41 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(1-methylpiperidin-3-yl)-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83255677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).