3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide

C15H23N3O3S — CID 51074453

IUPAC3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide
SMILESCOCCN(Cc1cccs1)C(=O)C1CCCN(C(N)=O)C1
InChIInChI=1S/C15H23N3O3S/c1-21-8-7-17(11-13-5-3-9-22-13)14(19)12-4-2-6-18(10-12)15(16)20/h3,5,9,12H,2,4,6-8,10-11H2,1H3,(H2,16,20)
InChIKeyGRIZIHZNSWZOJD-UHFFFAOYSA-N
MW325.43 g/mol
LogP1.51
Rot. Bonds6

About 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide

3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide (PubChem CID 51074453) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide
PubChem CID51074453
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC Name3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide
SMILESCOCCN(Cc1cccs1)C(=O)C1CCCN(C(N)=O)C1
InChIInChI=1S/C15H23N3O3S/c1-21-8-7-17(11-13-5-3-9-22-13)14(19)12-4-2-6-18(10-12)15(16)20/h3,5,9,12H,2,4,6-8,10-11H2,1H3,(H2,16,20)
InChIKeyGRIZIHZNSWZOJD-UHFFFAOYSA-N
XLogP1.51
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N~1~,N~1~-dimethyl-N~4~-(thien-2-ylmethyl)piperidine-1,4-dicarboxamide
CID 3239396
N,N-diethyl-1-[(3-methyl-2-thienyl)methyl]-3-piperidinecarboxamide
CID 2838079
N~1~,N~1~-dimethyl-N~3~-(thien-2-ylmethyl)piperidine-1,3-dicarboxamide
CID 3242124
Azepan-1-yl[1-(thiophen-2-ylmethyl)piperidin-3-yl]methanone
CID 3242035
3-N-methyl-3-N-[(3-methylthiophen-2-yl)methyl]piperidine-1,3-dicarboxamide
CID 45797441
3-N-(2-methoxyethyl)-3-N-[(3-methylthiophen-2-yl)methyl]piperidine-1,3-dicarboxamide
CID 50972849
1-isopropyl-N-(2-methoxyethyl)-N-[(3-methyl-2-thienyl)methyl]piperidine-4-carboxamide
CID 50976231
(3aR,7aR)-5-(2-methoxyethyl)-2-[(5-methylthiophen-2-yl)methyl]-1,3,3a,6,7,7a-hexahydropyrrolo[3,4-c]pyridin-4-one
CID 97377630
1-(2-methoxyethyl)-N-methyl-N-[(3-methyl-2-thienyl)methyl]-6-oxo-3-piperidinecarboxamide
CID 72866635
N-(2-methoxyethyl)-4-(thiophene-2-carbonyl)piperazine-1-carboxamide
CID 47128052
N-((1-(2-methoxyethyl)piperidin-4-yl)methyl)-2-(thiophen-2-yl)acetamide
CID 16895530
N-((1-(2-methoxyethyl)piperidin-4-yl)methyl)thiophene-2-carboxamide
CID 16895546

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide?
The IUPAC name of 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide (CID 51074453) is 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide?
The canonical SMILES for 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide is COCCN(Cc1cccs1)C(=O)C1CCCN(C(N)=O)C1.
What is the InChIKey of 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide?
The InChIKey is GRIZIHZNSWZOJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-21-8-7-17(11-13-5-3-9-22-13)14(19)12-4-2-6-18(10-12)15(16)20/h3,5,9,12H,2,4,6-8,10-11H2,1H3,(H2,16,20).
What are the key properties of 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide?
3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide has a molecular weight of 325.43 g/mol, XLogP of 1.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-methoxyethyl)-3-N-(thiophen-2-ylmethyl)piperidine-1,3-dicarboxamide is sourced from PubChem (CID 51074453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).