4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide

C15H24N4O2S — CID 94156776

IUPAC4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide
SMILESCN(C)[C@H](CNC(=O)C1CCN(C(N)=O)CC1)c1cccs1
InChIInChI=1S/C15H24N4O2S/c1-18(2)12(13-4-3-9-22-13)10-17-14(20)11-5-7-19(8-6-11)15(16)21/h3-4,9,11-12H,5-8,10H2,1-2H3,(H2,16,21)(H,17,20)/t12-/m1/s1
InChIKeyPFUWNWPSEZEGHK-GFCCVEGCSA-N
MW324.45 g/mol
LogP1.26
Rot. Bonds5

About 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide

4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide (PubChem CID 94156776) has the molecular formula C15H24N4O2S and a molecular weight of 324.45 g/mol. Its IUPAC name is 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide
PubChem CID94156776
Molecular FormulaC15H24N4O2S
Molecular Weight324.45 g/mol
Exact Mass324.16
IUPAC Name4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide
SMILESCN(C)[C@H](CNC(=O)C1CCN(C(N)=O)CC1)c1cccs1
InChIInChI=1S/C15H24N4O2S/c1-18(2)12(13-4-3-9-22-13)10-17-14(20)11-5-7-19(8-6-11)15(16)21/h3-4,9,11-12H,5-8,10H2,1-2H3,(H2,16,21)(H,17,20)/t12-/m1/s1
InChIKeyPFUWNWPSEZEGHK-GFCCVEGCSA-N
XLogP1.26
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide (CID 94156776) is 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide is CN(C)[C@H](CNC(=O)C1CCN(C(N)=O)CC1)c1cccs1.
What is the InChIKey of 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide?
The InChIKey is PFUWNWPSEZEGHK-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H24N4O2S/c1-18(2)12(13-4-3-9-22-13)10-17-14(20)11-5-7-19(8-6-11)15(16)21/h3-4,9,11-12H,5-8,10H2,1-2H3,(H2,16,21)(H,17,20)/t12-/m1/s1.
What are the key properties of 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide?
4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide has a molecular weight of 324.45 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]piperidine-1,4-dicarboxamide is sourced from PubChem (CID 94156776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).