(2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone

C17H24N2O2S — CID 17224089

IUPAC(2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
SMILESCC1CCCCN1C(=O)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C17H24N2O2S/c1-13-5-2-3-9-19(13)16(20)14-7-10-18(11-8-14)17(21)15-6-4-12-22-15/h4,6,12-14H,2-3,5,7-11H2,1H3
InChIKeyMADPWENAELHOIQ-UHFFFAOYSA-N
MW320.46 g/mol
LogP3.00
Rot. Bonds2

About (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone

(2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone (PubChem CID 17224089) has the molecular formula C17H24N2O2S and a molecular weight of 320.46 g/mol. Its IUPAC name is (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Name(2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
PubChem CID17224089
Molecular FormulaC17H24N2O2S
Molecular Weight320.46 g/mol
Exact Mass320.16
IUPAC Name(2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
SMILESCC1CCCCN1C(=O)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C17H24N2O2S/c1-13-5-2-3-9-19(13)16(20)14-7-10-18(11-8-14)17(21)15-6-4-12-22-15/h4,6,12-14H,2-3,5,7-11H2,1H3
InChIKeyMADPWENAELHOIQ-UHFFFAOYSA-N
XLogP3.00
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.46
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(2R)-2-ethylpiperidin-1-yl]-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 27244606
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 27261466
2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 55806549
[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 8732831
ethane;(4-methylpiperidin-1-yl)-thiophen-2-ylmethanone
CID 142506623
1-(thiophene-2-carbonyl)piperidine-4-carboxylic acid
CID 760311
1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 750217
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 27260871
N-(2-methylpiperidine-1-carbothioyl)thiophene-2-carboxamide
CID 5201242
[3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]-thiophen-2-ylmethanone
CID 2896965
(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-thiophen-2-ylmethanone
CID 78992376
[(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 41041616

Frequently Asked Questions

What is the IUPAC name of (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone?
The IUPAC name of (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone (CID 17224089) is (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone.
What is the SMILES notation for (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone?
The canonical SMILES for (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone is CC1CCCCN1C(=O)C1CCN(C(=O)c2cccs2)CC1.
What is the InChIKey of (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone?
The InChIKey is MADPWENAELHOIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2S/c1-13-5-2-3-9-19(13)16(20)14-7-10-18(11-8-14)17(21)15-6-4-12-22-15/h4,6,12-14H,2-3,5,7-11H2,1H3.
What are the key properties of (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone?
(2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone has a molecular weight of 320.46 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpiperidin-1-yl)-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone is sourced from PubChem (CID 17224089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).