2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole

C14H25N3S — CID 116967569

IUPAC2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole
SMILESCC(C)c1csc(C(C)(C)CN2CCNCC2)n1
InChIInChI=1S/C14H25N3S/c1-11(2)12-9-18-13(16-12)14(3,4)10-17-7-5-15-6-8-17/h9,11,15H,5-8,10H2,1-4H3
InChIKeyUXHDAEIVIFHBBL-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.45
Rot. Bonds4

About 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole

2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole (PubChem CID 116967569) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole
PubChem CID116967569
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole
SMILESCC(C)c1csc(C(C)(C)CN2CCNCC2)n1
InChIInChI=1S/C14H25N3S/c1-11(2)12-9-18-13(16-12)14(3,4)10-17-7-5-15-6-8-17/h9,11,15H,5-8,10H2,1-4H3
InChIKeyUXHDAEIVIFHBBL-UHFFFAOYSA-N
XLogP2.45
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-ol
CID 116865464
2-tert-butyl-4-propan-2-yl-1,3-thiazole
CID 22975254
2-(1,4-diazepan-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
CID 55121452
2-(2-ethoxypropan-2-yl)-4-propan-2-yl-1,3-thiazole
CID 116734587
4-(2-methyl-2-piperazin-1-ylpropyl)-2-propan-2-yl-1,3-thiazole
CID 116891607
2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylpentan-2-amine
CID 61333805
2-[4-(4-propan-2-yl-1,3-thiazol-2-yl)piperazin-1-yl]ethanamine
CID 82167547
3-(2-methyl-1-piperazin-1-ylpropan-2-yl)quinoline
CID 116985177
1-cyclopropyl-N-methyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 64918687
2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylbutan-2-amine
CID 61335180
1-methoxy-N-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)propan-2-amine
CID 62536660
2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propylpyrimidine
CID 116903444

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole (CID 116967569) is 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole is CC(C)c1csc(C(C)(C)CN2CCNCC2)n1.
What is the InChIKey of 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole?
The InChIKey is UXHDAEIVIFHBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-11(2)12-9-18-13(16-12)14(3,4)10-17-7-5-15-6-8-17/h9,11,15H,5-8,10H2,1-4H3.
What are the key properties of 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole?
2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole has a molecular weight of 267.44 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1-piperazin-1-ylpropan-2-yl)-4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 116967569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).