3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride

C13H21ClN2OS — CID 120575332

IUPAC3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride
SMILESCCc1ccsc1C(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C13H20N2OS.ClH/c1-3-10-6-8-17-12(10)13(16)15-11-5-4-7-14-9(11)2;/h6,8-9,11,14H,3-5,7H2,1-2H3,(H,15,16);1H
InChIKeyGWRCZOFLMQPFOD-UHFFFAOYSA-N
MW288.84 g/mol
LogP2.60
Rot. Bonds3

About 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride

3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride (PubChem CID 120575332) has the molecular formula C13H21ClN2OS and a molecular weight of 288.84 g/mol. Its IUPAC name is 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride
PubChem CID120575332
Molecular FormulaC13H21ClN2OS
Molecular Weight288.84 g/mol
Exact Mass288.11
IUPAC Name3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride
SMILESCCc1ccsc1C(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C13H20N2OS.ClH/c1-3-10-6-8-17-12(10)13(16)15-11-5-4-7-14-9(11)2;/h6,8-9,11,14H,3-5,7H2,1-2H3,(H,15,16);1H
InChIKeyGWRCZOFLMQPFOD-UHFFFAOYSA-N
XLogP2.60
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.84
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1R,2S)-2-[(3-ethylthiophene-2-carbonyl)amino]cyclohexane-1-carboxylic acid
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3-ethyl-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide
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N-[2-(bromomethyl)cyclopentyl]-3-ethylthiophene-2-carboxamide
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N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
4-[[ethyl(propan-2-yl)amino]methyl]-N-(2-methylpiperidin-3-yl)benzamide;dihydrochloride
CID 120576871
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CID 120576827

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride (CID 120575332) is 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride is CCc1ccsc1C(=O)NC1CCCNC1C.Cl.
What is the InChIKey of 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is GWRCZOFLMQPFOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS.ClH/c1-3-10-6-8-17-12(10)13(16)15-11-5-4-7-14-9(11)2;/h6,8-9,11,14H,3-5,7H2,1-2H3,(H,15,16);1H.
What are the key properties of 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride?
3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 288.84 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-methylpiperidin-3-yl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 120575332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).