4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride

C11H14ClN3S — CID 45259316

IUPAC4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride
SMILESCl.c1cc2sccc2c(N2CCNCC2)n1
InChIInChI=1S/C11H13N3S.ClH/c1-3-13-11(9-2-8-15-10(1)9)14-6-4-12-5-7-14;/h1-3,8,12H,4-7H2;1H
InChIKeyINUOKPQZHKHMHH-UHFFFAOYSA-N
MW255.77 g/mol
LogP2.13
Rot. Bonds1

About 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride

4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride (PubChem CID 45259316) has the molecular formula C11H14ClN3S and a molecular weight of 255.77 g/mol. Its IUPAC name is 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride.

Molecular Properties

Compound Name4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride
PubChem CID45259316
Molecular FormulaC11H14ClN3S
Molecular Weight255.77 g/mol
Exact Mass255.06
IUPAC Name4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride
SMILESCl.c1cc2sccc2c(N2CCNCC2)n1
InChIInChI=1S/C11H13N3S.ClH/c1-3-13-11(9-2-8-15-10(1)9)14-6-4-12-5-7-14;/h1-3,8,12H,4-7H2;1H
InChIKeyINUOKPQZHKHMHH-UHFFFAOYSA-N
XLogP2.13
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.77
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride?
The IUPAC name of 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride (CID 45259316) is 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride.
What is the SMILES notation for 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride?
The canonical SMILES for 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride is Cl.c1cc2sccc2c(N2CCNCC2)n1.
What is the InChIKey of 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride?
The InChIKey is INUOKPQZHKHMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S.ClH/c1-3-13-11(9-2-8-15-10(1)9)14-6-4-12-5-7-14;/h1-3,8,12H,4-7H2;1H.
What are the key properties of 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride?
4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride has a molecular weight of 255.77 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperazin-1-ylthieno[3,2-c]pyridine;hydrochloride is sourced from PubChem (CID 45259316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).