thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone

C14H15NO2S2 — CID 122246200

IUPACthiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone
SMILESO=C(c1cccs1)N1CCC(Oc2ccsc2)CC1
InChIInChI=1S/C14H15NO2S2/c16-14(13-2-1-8-19-13)15-6-3-11(4-7-15)17-12-5-9-18-10-12/h1-2,5,8-11H,3-4,6-7H2
InChIKeyFBBCZPXYRRDQNY-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.49
Rot. Bonds3

About thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone

thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone (PubChem CID 122246200) has the molecular formula C14H15NO2S2 and a molecular weight of 293.41 g/mol. Its IUPAC name is thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone.

Molecular Properties

Compound Namethiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone
PubChem CID122246200
Molecular FormulaC14H15NO2S2
Molecular Weight293.41 g/mol
Exact Mass293.05
IUPAC Namethiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone
SMILESO=C(c1cccs1)N1CCC(Oc2ccsc2)CC1
InChIInChI=1S/C14H15NO2S2/c16-14(13-2-1-8-19-13)15-6-3-11(4-7-15)17-12-5-9-18-10-12/h1-2,5,8-11H,3-4,6-7H2
InChIKeyFBBCZPXYRRDQNY-UHFFFAOYSA-N
XLogP3.49
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone?
The IUPAC name of thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone (CID 122246200) is thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone.
What is the SMILES notation for thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone?
The canonical SMILES for thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone is O=C(c1cccs1)N1CCC(Oc2ccsc2)CC1.
What is the InChIKey of thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone?
The InChIKey is FBBCZPXYRRDQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S2/c16-14(13-2-1-8-19-13)15-6-3-11(4-7-15)17-12-5-9-18-10-12/h1-2,5,8-11H,3-4,6-7H2.
What are the key properties of thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone?
thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone has a molecular weight of 293.41 g/mol, XLogP of 3.49, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for thiophen-2-yl-(4-thiophen-3-yloxypiperidin-1-yl)methanone is sourced from PubChem (CID 122246200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).