N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide

C12H18N2OS — CID 62842811

IUPACN-(1-thiophen-3-ylethyl)piperidine-2-carboxamide
SMILESCC(NC(=O)C1CCCCN1)c1ccsc1
InChIInChI=1S/C12H18N2OS/c1-9(10-5-7-16-8-10)14-12(15)11-4-2-3-6-13-11/h5,7-9,11,13H,2-4,6H2,1H3,(H,14,15)
InChIKeyCOFDKZURICYOAV-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.07
Rot. Bonds3

About N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide

N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide (PubChem CID 62842811) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(1-thiophen-3-ylethyl)piperidine-2-carboxamide
PubChem CID62842811
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC NameN-(1-thiophen-3-ylethyl)piperidine-2-carboxamide
SMILESCC(NC(=O)C1CCCCN1)c1ccsc1
InChIInChI=1S/C12H18N2OS/c1-9(10-5-7-16-8-10)14-12(15)11-4-2-3-6-13-11/h5,7-9,11,13H,2-4,6H2,1H3,(H,14,15)
InChIKeyCOFDKZURICYOAV-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-phenylethyl]piperidine-2-carboxamide
CID 15445575
N-[(1S)-1-(4-methylphenyl)ethyl]piperidine-2-carboxamide
CID 81355602
(2S)-N-[1-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 75495928
N-[(1R)-1-phenylethyl]azepane-2-carboxamide
CID 78996687
N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-2-carboxamide
CID 43705280
N-[(1R)-1-pyridin-4-ylethyl]piperidine-2-carboxamide
CID 81410506
(2R)-N-[1-(4-bromophenyl)ethyl]piperidine-2-carboxamide
CID 103809894
N-(1-thiophen-2-ylethyl)azepane-2-carboxamide
CID 64563977
(2R)-N-[(1S)-1-(4-methoxyphenyl)ethyl]piperidine-2-carboxamide
CID 104914369
(2R)-N-[1-(1,3-thiazol-2-yl)ethyl]piperidine-2-carboxamide
CID 103814463
(2S)-N-[(1R)-1-(4-methylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 81356074
N-(1-phenylethyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119261657

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide?
The IUPAC name of N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide (CID 62842811) is N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide?
The canonical SMILES for N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide is CC(NC(=O)C1CCCCN1)c1ccsc1.
What is the InChIKey of N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide?
The InChIKey is COFDKZURICYOAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-9(10-5-7-16-8-10)14-12(15)11-4-2-3-6-13-11/h5,7-9,11,13H,2-4,6H2,1H3,(H,14,15).
What are the key properties of N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide?
N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide has a molecular weight of 238.36 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-3-ylethyl)piperidine-2-carboxamide is sourced from PubChem (CID 62842811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).