(4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone

C15H23NO2S — CID 71943781

IUPAC(4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone
SMILESCCCc1cc(C(=O)N2CCC(OC)CC2)sc1C
InChIInChI=1S/C15H23NO2S/c1-4-5-12-10-14(19-11(12)2)15(17)16-8-6-13(18-3)7-9-16/h10,13H,4-9H2,1-3H3
InChIKeyOEDBZEFQLCPYQV-UHFFFAOYSA-N
MW281.42 g/mol
LogP3.26
Rot. Bonds4

About (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone

(4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone (PubChem CID 71943781) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone.

Molecular Properties

Compound Name(4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone
PubChem CID71943781
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC Name(4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone
SMILESCCCc1cc(C(=O)N2CCC(OC)CC2)sc1C
InChIInChI=1S/C15H23NO2S/c1-4-5-12-10-14(19-11(12)2)15(17)16-8-6-13(18-3)7-9-16/h10,13H,4-9H2,1-3H3
InChIKeyOEDBZEFQLCPYQV-UHFFFAOYSA-N
XLogP3.26
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

azetidin-1-yl-(5-methyl-4-propylthiophen-2-yl)methanone
CID 39959347
(3,4-dihydroxypyrrolidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone
CID 106671858
(3-hydroxyazetidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone
CID 63107136
(4-ethyl-5-methylthiophen-2-yl)-(4-methylpiperidin-1-yl)methanone
CID 78785729
6-(5-methyl-4-propylthiophene-2-carbonyl)-6-azaspiro[2.5]octane-2-carboxylic acid
CID 119175440
4-methyl-1-(5-methyl-4-propylthiophene-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 63720659
2-[1-(5-methyl-4-propylthiophene-2-carbonyl)azetidin-3-yl]propanoic acid
CID 116681485
2,3-dihydro-1,4-benzodioxin-6-yl-[1-(5-methyl-4-propylthiophene-2-carbonyl)piperidin-4-yl]methanone
CID 33184971
(4,5-dibromothiophen-2-yl)-(4-methoxypiperidin-1-yl)methanone
CID 47131293
1-(5-methyl-4-propylthiophene-2-carbonyl)-4-phenylpiperidine-4-carboxylic acid
CID 45433624
azepan-1-yl-(4-ethyl-5-methylthiophen-2-yl)methanone
CID 60634850
N-(1,3-benzodioxol-5-yl)-1-(5-methyl-4-propylthiophene-2-carbonyl)piperidine-4-carboxamide
CID 41410677

Frequently Asked Questions

What is the IUPAC name of (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone?
The IUPAC name of (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone (CID 71943781) is (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone.
What is the SMILES notation for (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone?
The canonical SMILES for (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone is CCCc1cc(C(=O)N2CCC(OC)CC2)sc1C.
What is the InChIKey of (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone?
The InChIKey is OEDBZEFQLCPYQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-4-5-12-10-14(19-11(12)2)15(17)16-8-6-13(18-3)7-9-16/h10,13H,4-9H2,1-3H3.
What are the key properties of (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone?
(4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone has a molecular weight of 281.42 g/mol, XLogP of 3.26, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxypiperidin-1-yl)-(5-methyl-4-propylthiophen-2-yl)methanone is sourced from PubChem (CID 71943781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).