1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one

C15H22N4O2S — CID 47073365

IUPAC1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one
SMILESO=C(CN1CCN(CCc2cccs2)CC1)N1CCNC1=O
InChIInChI=1S/C15H22N4O2S/c20-14(19-6-4-16-15(19)21)12-18-9-7-17(8-10-18)5-3-13-2-1-11-22-13/h1-2,11H,3-10,12H2,(H,16,21)
InChIKeyGHDICFPAOLUXDR-UHFFFAOYSA-N
MW322.43 g/mol
LogP0.46
Rot. Bonds5

About 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one

1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one (PubChem CID 47073365) has the molecular formula C15H22N4O2S and a molecular weight of 322.43 g/mol. Its IUPAC name is 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one
PubChem CID47073365
Molecular FormulaC15H22N4O2S
Molecular Weight322.43 g/mol
Exact Mass322.15
IUPAC Name1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one
SMILESO=C(CN1CCN(CCc2cccs2)CC1)N1CCNC1=O
InChIInChI=1S/C15H22N4O2S/c20-14(19-6-4-16-15(19)21)12-18-9-7-17(8-10-18)5-3-13-2-1-11-22-13/h1-2,11H,3-10,12H2,(H,16,21)
InChIKeyGHDICFPAOLUXDR-UHFFFAOYSA-N
XLogP0.46
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.43
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]ethanone
CID 95761889
1-[2-oxo-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]ethyl]pyrimidin-2-one
CID 136578933
methyl 3-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]piperazin-1-yl]propanoate
CID 78983614
4-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]ethyl]morpholine
CID 60575640
1-[2-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]acetyl]imidazolidin-2-one
CID 95334948
N-(cyclohexylcarbamoyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide
CID 47073373
4-(2-oxo-2-piperidin-1-ylethyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
CID 86912732
1-(azepan-1-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanone
CID 78808495
1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]imidazolidin-2-one
CID 8897146
(5Z)-3-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]-5-(thiophen-2-ylmethylidene)-1,3-thiazolidine-2,4-dione
CID 42263045
1-[2-[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylpropanoyl]imidazolidin-2-one
CID 17437207
1-[(2S)-2-[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylpropanoyl]imidazolidin-2-one
CID 40798767

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one (CID 47073365) is 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one is O=C(CN1CCN(CCc2cccs2)CC1)N1CCNC1=O.
What is the InChIKey of 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one?
The InChIKey is GHDICFPAOLUXDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2S/c20-14(19-6-4-16-15(19)21)12-18-9-7-17(8-10-18)5-3-13-2-1-11-22-13/h1-2,11H,3-10,12H2,(H,16,21).
What are the key properties of 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one?
1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one has a molecular weight of 322.43 g/mol, XLogP of 0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetyl]imidazolidin-2-one is sourced from PubChem (CID 47073365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).