furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone

C17H18N2O3S — CID 30944839

IUPACfuran-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCN(C(=O)C2(c3cccs3)CC2)CC1
InChIInChI=1S/C17H18N2O3S/c20-15(13-3-1-11-22-13)18-7-9-19(10-8-18)16(21)17(5-6-17)14-4-2-12-23-14/h1-4,11-12H,5-10H2
InChIKeyZTKARBBGVLGMOY-UHFFFAOYSA-N
MW330.41 g/mol
LogP2.36
Rot. Bonds3

About furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone

furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone (PubChem CID 30944839) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone
PubChem CID30944839
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC Namefuran-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone
SMILESO=C(c1ccco1)N1CCN(C(=O)C2(c3cccs3)CC2)CC1
InChIInChI=1S/C17H18N2O3S/c20-15(13-3-1-11-22-13)18-7-9-19(10-8-18)16(21)17(5-6-17)14-4-2-12-23-14/h1-4,11-12H,5-10H2
InChIKeyZTKARBBGVLGMOY-UHFFFAOYSA-N
XLogP2.36
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

furan-2-yl-[4-(1-hydroxycyclopentanecarbonyl)piperazin-1-yl]methanone
CID 110906971
furan-2-yl-[4-(1-thiophen-2-ylethyl)piperazin-1-yl]methanone
CID 110664567
[4-(furan-2-carbonyl)piperazin-1-yl]-[(1S,2R)-2-thiophen-2-ylcyclopropyl]methanone
CID 95967610
furan-2-yl-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone
CID 756358
furan-2-yl(thiomorpholin-4-yl)methanone
CID 2804982
piperazin-1-yl-(1-thiophen-2-ylcyclohexyl)methanone
CID 119402420
furan-2-yl-[4-(1-pyrrol-1-ylcyclohexanecarbonyl)piperazin-1-yl]methanone
CID 46328246
azepan-1-yl(furan-2-yl)methanone
CID 5200992
4-(furan-2-carbonyl)-N-(2-thiophen-2-ylethyl)piperazine-1-carboxamide
CID 3830233
2-[4-(furan-2-carbonyl)piperazin-1-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone
CID 8544458
[4-(furan-2-carbonyl)piperazin-1-yl]-thiophen-3-ylmethanone
CID 60656601
[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl] thiophene-2-carboxylate
CID 2355144

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone?
The IUPAC name of furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone (CID 30944839) is furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone is O=C(c1ccco1)N1CCN(C(=O)C2(c3cccs3)CC2)CC1.
What is the InChIKey of furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone?
The InChIKey is ZTKARBBGVLGMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c20-15(13-3-1-11-22-13)18-7-9-19(10-8-18)16(21)17(5-6-17)14-4-2-12-23-14/h1-4,11-12H,5-10H2.
What are the key properties of furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone?
furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone has a molecular weight of 330.41 g/mol, XLogP of 2.36, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(1-thiophen-2-ylcyclopropanecarbonyl)piperazin-1-yl]methanone is sourced from PubChem (CID 30944839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).