4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride

C13H21ClN2OS — CID 119473981

IUPAC4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride
SMILESCc1cscc1C(=O)NC(C)C1CCCNC1.Cl
InChIInChI=1S/C13H20N2OS.ClH/c1-9-7-17-8-12(9)13(16)15-10(2)11-4-3-5-14-6-11;/h7-8,10-11,14H,3-6H2,1-2H3,(H,15,16);1H
InChIKeyHHOPODCIGOFCAI-UHFFFAOYSA-N
MW288.84 g/mol
LogP2.60
Rot. Bonds3

About 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride

4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride (PubChem CID 119473981) has the molecular formula C13H21ClN2OS and a molecular weight of 288.84 g/mol. Its IUPAC name is 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride
PubChem CID119473981
Molecular FormulaC13H21ClN2OS
Molecular Weight288.84 g/mol
Exact Mass288.11
IUPAC Name4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride
SMILESCc1cscc1C(=O)NC(C)C1CCCNC1.Cl
InChIInChI=1S/C13H20N2OS.ClH/c1-9-7-17-8-12(9)13(16)15-10(2)11-4-3-5-14-6-11;/h7-8,10-11,14H,3-6H2,1-2H3,(H,15,16);1H
InChIKeyHHOPODCIGOFCAI-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

2-hydroxy-3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 43523069
2-iodo-3-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 103806068
5-fluoro-2-methyl-N-(1-piperidin-3-ylethyl)benzamide
CID 55144400
2-chloro-N-(1-piperidin-3-ylethyl)benzamide
CID 62034679
2,3-difluoro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119474254
2,3-dichloro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119473892
2-methyl-4-nitro-N-(1-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119474115
4-methyl-N-pyrrolidin-3-ylthiophene-3-carboxamide
CID 79808924
2-methyl-N-(1-piperidin-3-ylethyl)-1,3-thiazole-5-carboxamide
CID 113265500
N-(1-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide;hydrochloride
CID 119473992
N-(1-piperidin-3-ylethyl)naphthalene-1-carboxamide
CID 43523096
5-bromo-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide
CID 113265499

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride?
The IUPAC name of 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride (CID 119473981) is 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride.
What is the SMILES notation for 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride?
The canonical SMILES for 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride is Cc1cscc1C(=O)NC(C)C1CCCNC1.Cl.
What is the InChIKey of 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride?
The InChIKey is HHOPODCIGOFCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS.ClH/c1-9-7-17-8-12(9)13(16)15-10(2)11-4-3-5-14-6-11;/h7-8,10-11,14H,3-6H2,1-2H3,(H,15,16);1H.
What are the key properties of 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride?
4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-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 4-methyl-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide;hydrochloride is sourced from PubChem (CID 119473981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).