(4-methoxythiophen-2-yl)-piperidin-1-ylmethanone

C11H15NO2S — CID 79459949

IUPAC(4-methoxythiophen-2-yl)-piperidin-1-ylmethanone
SMILESCOc1csc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C11H15NO2S/c1-14-9-7-10(15-8-9)11(13)12-5-3-2-4-6-12/h7-8H,2-6H2,1H3
InChIKeyXHZDVGJJXKJENQ-UHFFFAOYSA-N
MW225.31 g/mol
LogP2.38
Rot. Bonds2

About (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone

(4-methoxythiophen-2-yl)-piperidin-1-ylmethanone (PubChem CID 79459949) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(4-methoxythiophen-2-yl)-piperidin-1-ylmethanone
PubChem CID79459949
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name(4-methoxythiophen-2-yl)-piperidin-1-ylmethanone
SMILESCOc1csc(C(=O)N2CCCCC2)c1
InChIInChI=1S/C11H15NO2S/c1-14-9-7-10(15-8-9)11(13)12-5-3-2-4-6-12/h7-8H,2-6H2,1H3
InChIKeyXHZDVGJJXKJENQ-UHFFFAOYSA-N
XLogP2.38
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxythiophen-2-yl)-[(3R)-3-(methylamino)piperidin-1-yl]methanone
CID 124572642
[4-(1-hydroxyethyl)piperidin-1-yl]-(4-methoxythiophen-2-yl)methanone
CID 103720299
(4-methoxythiophen-2-yl)-[4-methyl-4-(methylamino)piperidin-1-yl]methanone
CID 115304268
(4-methoxythiophen-2-yl)-[3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119491500
N-(2-aminoethyl)-1-(4-methoxythiophene-2-carbonyl)piperidine-3-carboxamide
CID 81121460
[4-[(4-methoxyphenoxy)methyl]thiophen-2-yl]-pyrrolidin-1-ylmethanone
CID 19499165
[3-(1-aminoethyl)piperidin-1-yl]-(4-methoxythiophen-2-yl)methanone
CID 81119549
azepan-1-yl-(4-bromothiophen-2-yl)methanone
CID 2225278
2-[1-(4-methoxythiophene-2-carbonyl)piperidin-4-yl]oxyacetic acid
CID 81127210
2-[4-(4-methoxythiophene-2-carbonyl)piperazin-1-yl]-3-methylbutanenitrile
CID 71865601
(3R)-1-(4-methoxythiophene-2-carbonyl)-3-methylpyrrolidine-3-carboxylic acid
CID 124596105
2-[4-(4-methoxythiophene-2-carbonyl)piperazin-1-yl]butanethioamide
CID 81121719

Frequently Asked Questions

What is the IUPAC name of (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone?
The IUPAC name of (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone (CID 79459949) is (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone is COc1csc(C(=O)N2CCCCC2)c1.
What is the InChIKey of (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone?
The InChIKey is XHZDVGJJXKJENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-14-9-7-10(15-8-9)11(13)12-5-3-2-4-6-12/h7-8H,2-6H2,1H3.
What are the key properties of (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone?
(4-methoxythiophen-2-yl)-piperidin-1-ylmethanone has a molecular weight of 225.31 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxythiophen-2-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 79459949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).