4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine

C11H23N3OS — CID 155003920

IUPAC4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine
SMILESCC(C)C1CNC(OCC2CSCN2)CN1
InChIInChI=1S/C11H23N3OS/c1-8(2)10-3-13-11(4-12-10)15-5-9-6-16-7-14-9/h8-14H,3-7H2,1-2H3
InChIKeyDHIFGTFVDAMPJE-UHFFFAOYSA-N
MW245.39 g/mol
LogP0.21
Rot. Bonds4

About 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine

4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine (PubChem CID 155003920) has the molecular formula C11H23N3OS and a molecular weight of 245.39 g/mol. Its IUPAC name is 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine.

Molecular Properties

Compound Name4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine
PubChem CID155003920
Molecular FormulaC11H23N3OS
Molecular Weight245.39 g/mol
Exact Mass245.16
IUPAC Name4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine
SMILESCC(C)C1CNC(OCC2CSCN2)CN1
InChIInChI=1S/C11H23N3OS/c1-8(2)10-3-13-11(4-12-10)15-5-9-6-16-7-14-9/h8-14H,3-7H2,1-2H3
InChIKeyDHIFGTFVDAMPJE-UHFFFAOYSA-N
XLogP0.21
TPSA45.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.39
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine
CID 155003910
4-propan-2-yl-1,3-thiazolidine
CID 23588978
2-(2-imidazolidin-1-ylethoxy)-5-propan-2-ylpiperazine
CID 155003978
2-[(2S,5S)-5-propan-2-ylpiperazin-2-yl]ethanamine
CID 131048640
5-(methoxymethyl)-2-propan-2-ylpiperidine
CID 105434920
4-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazolidine
CID 43199782
(2R,4S)-4-(3-methylbutoxy)-2-propan-2-ylpyrrolidine
CID 99994737
4-[(4-methoxypiperidin-1-yl)methyl]-1,3-thiazolidine
CID 43373036
N,1-dimethyl-N-(1,3-thiazolidin-4-ylmethyl)piperidin-4-amine
CID 43199704
2-(1,3-thiazolidin-4-yl)acetamide
CID 139972017
4-[(2,6-dimethylpiperidin-1-yl)methyl]-1,3-thiazolidine
CID 43199796
(2R,4S)-4-(2-methoxyethoxy)-2-propan-2-ylpyrrolidine
CID 99994884

Frequently Asked Questions

What is the IUPAC name of 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine?
The IUPAC name of 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine (CID 155003920) is 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine.
What is the SMILES notation for 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine?
The canonical SMILES for 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine is CC(C)C1CNC(OCC2CSCN2)CN1.
What is the InChIKey of 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine?
The InChIKey is DHIFGTFVDAMPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3OS/c1-8(2)10-3-13-11(4-12-10)15-5-9-6-16-7-14-9/h8-14H,3-7H2,1-2H3.
What are the key properties of 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine?
4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine has a molecular weight of 245.39 g/mol, XLogP of 0.21, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-propan-2-ylpiperazin-2-yl)oxymethyl]-1,3-thiazolidine is sourced from PubChem (CID 155003920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).