4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide

C11H16N2OS — CID 66352171

IUPAC4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide
SMILESCC1(C(=O)Nc2ccsc2)CCNCC1
InChIInChI=1S/C11H16N2OS/c1-11(3-5-12-6-4-11)10(14)13-9-2-7-15-8-9/h2,7-8,12H,3-6H2,1H3,(H,13,14)
InChIKeyNKQPIQMEVQGGHH-UHFFFAOYSA-N
MW224.33 g/mol
LogP2.08
Rot. Bonds2

About 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide

4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide (PubChem CID 66352171) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide
PubChem CID66352171
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide
SMILESCC1(C(=O)Nc2ccsc2)CCNCC1
InChIInChI=1S/C11H16N2OS/c1-11(3-5-12-6-4-11)10(14)13-9-2-7-15-8-9/h2,7-8,12H,3-6H2,1H3,(H,13,14)
InChIKeyNKQPIQMEVQGGHH-UHFFFAOYSA-N
XLogP2.08
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide (CID 66352171) is 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide is CC1(C(=O)Nc2ccsc2)CCNCC1.
What is the InChIKey of 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide?
The InChIKey is NKQPIQMEVQGGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-11(3-5-12-6-4-11)10(14)13-9-2-7-15-8-9/h2,7-8,12H,3-6H2,1H3,(H,13,14).
What are the key properties of 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide?
4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide has a molecular weight of 224.33 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide is sourced from PubChem (CID 66352171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).