N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride

C12H19ClN2OS — CID 66570141

IUPACN,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride
SMILESCc1ccsc1C(=O)N(C)C1CCCNC1.Cl
InChIInChI=1S/C12H18N2OS.ClH/c1-9-5-7-16-11(9)12(15)14(2)10-4-3-6-13-8-10;/h5,7,10,13H,3-4,6,8H2,1-2H3;1H
InChIKeyIQEYSCFRARTLLG-UHFFFAOYSA-N
MW274.82 g/mol
LogP2.30
Rot. Bonds2

About N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride

N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride (PubChem CID 66570141) has the molecular formula C12H19ClN2OS and a molecular weight of 274.82 g/mol. Its IUPAC name is N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride
PubChem CID66570141
Molecular FormulaC12H19ClN2OS
Molecular Weight274.82 g/mol
Exact Mass274.09
IUPAC NameN,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride
SMILESCc1ccsc1C(=O)N(C)C1CCCNC1.Cl
InChIInChI=1S/C12H18N2OS.ClH/c1-9-5-7-16-11(9)12(15)14(2)10-4-3-6-13-8-10;/h5,7,10,13H,3-4,6,8H2,1-2H3;1H
InChIKeyIQEYSCFRARTLLG-UHFFFAOYSA-N
XLogP2.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.82
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride?
The IUPAC name of N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride (CID 66570141) is N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride?
The canonical SMILES for N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride is Cc1ccsc1C(=O)N(C)C1CCCNC1.Cl.
What is the InChIKey of N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride?
The InChIKey is IQEYSCFRARTLLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS.ClH/c1-9-5-7-16-11(9)12(15)14(2)10-4-3-6-13-8-10;/h5,7,10,13H,3-4,6,8H2,1-2H3;1H.
What are the key properties of N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride?
N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride has a molecular weight of 274.82 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-N-piperidin-3-ylthiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 66570141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).