4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine

C10H21N3S — CID 43199782

IUPAC4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine
SMILESCCN1CCN(CC2CSCN2)CC1
InChIInChI=1S/C10H21N3S/c1-2-12-3-5-13(6-4-12)7-10-8-14-9-11-10/h10-11H,2-9H2,1H3
InChIKeyZKFSHHURGNLCOR-UHFFFAOYSA-N
MW215.37 g/mol
LogP0.29
Rot. Bonds3

About 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine

4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine (PubChem CID 43199782) has the molecular formula C10H21N3S and a molecular weight of 215.37 g/mol. Its IUPAC name is 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine.

Molecular Properties

Compound Name4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine
PubChem CID43199782
Molecular FormulaC10H21N3S
Molecular Weight215.37 g/mol
Exact Mass215.15
IUPAC Name4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine
SMILESCCN1CCN(CC2CSCN2)CC1
InChIInChI=1S/C10H21N3S/c1-2-12-3-5-13(6-4-12)7-10-8-14-9-11-10/h10-11H,2-9H2,1H3
InChIKeyZKFSHHURGNLCOR-UHFFFAOYSA-N
XLogP0.29
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.37
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine?
The IUPAC name of 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine (CID 43199782) is 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine.
What is the SMILES notation for 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine?
The canonical SMILES for 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine is CCN1CCN(CC2CSCN2)CC1.
What is the InChIKey of 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine?
The InChIKey is ZKFSHHURGNLCOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3S/c1-2-12-3-5-13(6-4-12)7-10-8-14-9-11-10/h10-11H,2-9H2,1H3.
What are the key properties of 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine?
4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine has a molecular weight of 215.37 g/mol, XLogP of 0.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine is sourced from PubChem (CID 43199782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).