4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide

C13H20N2OS — CID 63122358

IUPAC4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide
SMILESCC1(C(=O)NCCc2ccsc2)CCNCC1
InChIInChI=1S/C13H20N2OS/c1-13(4-7-14-8-5-13)12(16)15-6-2-11-3-9-17-10-11/h3,9-10,14H,2,4-8H2,1H3,(H,15,16)
InChIKeyYHDYDIXEWMVWHW-UHFFFAOYSA-N
MW252.38 g/mol
LogP1.80
Rot. Bonds4

About 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide

4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide (PubChem CID 63122358) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide
PubChem CID63122358
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC Name4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide
SMILESCC1(C(=O)NCCc2ccsc2)CCNCC1
InChIInChI=1S/C13H20N2OS/c1-13(4-7-14-8-5-13)12(16)15-6-2-11-3-9-17-10-11/h3,9-10,14H,2,4-8H2,1H3,(H,15,16)
InChIKeyYHDYDIXEWMVWHW-UHFFFAOYSA-N
XLogP1.80
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(2-pyridin-4-ylethyl)piperidine-4-carboxamide
CID 55177553
3-methyl-N-(thiophen-3-ylmethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119716336
1-(3-methylpyrrolidin-3-yl)-3-thiophen-3-ylpropan-1-one
CID 116570036
4-methyl-N-thiophen-3-ylpiperidine-4-carboxamide
CID 66352171
4-methyl-N-[2-(2-methylphenyl)ethyl]piperidine-4-carboxamide
CID 79749001
1-(aminomethyl)-N-(2-thiophen-3-ylethyl)cyclobutane-1-carboxamide
CID 115448466
1-(1-methylcyclopentyl)-3-thiophen-3-ylpropan-1-one
CID 114972116
(4-methylpiperidin-4-yl)-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone
CID 63122301
methyl 3-[(4-methylpiperidine-4-carbonyl)amino]propanoate
CID 63122388
(2S)-N-(2-thiophen-3-ylethyl)pyrrolidine-2-carboxamide
CID 61474678
3-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidine-3-carboxamide
CID 63239936
(3R)-N-(2-thiophen-3-ylethyl)piperidine-3-carboxamide
CID 81140487

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide (CID 63122358) is 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide is CC1(C(=O)NCCc2ccsc2)CCNCC1.
What is the InChIKey of 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide?
The InChIKey is YHDYDIXEWMVWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-13(4-7-14-8-5-13)12(16)15-6-2-11-3-9-17-10-11/h3,9-10,14H,2,4-8H2,1H3,(H,15,16).
What are the key properties of 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide?
4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide has a molecular weight of 252.38 g/mol, XLogP of 1.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-thiophen-3-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 63122358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).