2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole

C15H25N3S — CID 64942052

IUPAC2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole
SMILESCCC(c1nccs1)N1CC(C)(C2CC2)NCC1C
InChIInChI=1S/C15H25N3S/c1-4-13(14-16-7-8-19-14)18-10-15(3,12-5-6-12)17-9-11(18)2/h7-8,11-13,17H,4-6,9-10H2,1-3H3
InChIKeyGIDJMWCCCKUIAQ-UHFFFAOYSA-N
MW279.45 g/mol
LogP3.06
Rot. Bonds4

About 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole

2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole (PubChem CID 64942052) has the molecular formula C15H25N3S and a molecular weight of 279.45 g/mol. Its IUPAC name is 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole
PubChem CID64942052
Molecular FormulaC15H25N3S
Molecular Weight279.45 g/mol
Exact Mass279.18
IUPAC Name2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole
SMILESCCC(c1nccs1)N1CC(C)(C2CC2)NCC1C
InChIInChI=1S/C15H25N3S/c1-4-13(14-16-7-8-19-14)18-10-15(3,12-5-6-12)17-9-11(18)2/h7-8,11-13,17H,4-6,9-10H2,1-3H3
InChIKeyGIDJMWCCCKUIAQ-UHFFFAOYSA-N
XLogP3.06
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.45
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(2-methyl-5-phenylpiperazin-1-yl)propyl]-1,3-thiazole
CID 64941668
5-cyclopropyl-2,5-dimethyl-1-(1-thiophen-2-ylethyl)piperazine
CID 64933400
2-[(5-cyclopropyl-2-ethyl-5-methylpiperazin-1-yl)methyl]-1,3-thiazole
CID 64948017
2-[1-(2-propan-2-ylpiperazin-1-yl)propyl]-1,3-thiazole
CID 64932330
2-[1-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-1,3-thiazole
CID 64939348
2-[2-(5-cyclopropyl-5-methyl-2-propan-2-ylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64940605
2,5,5-trimethyl-1-(1-thiophen-2-ylpropyl)piperazine
CID 64946281
2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole
CID 106389937
2-[1-(3-ethyl-3-methyl-1,4-diazepan-1-yl)propyl]-1,3-thiazole
CID 64951418
1-butan-2-yl-3-cyclopropyl-3,7-dimethyl-1,4-diazepane
CID 79451068
2-[(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)methyl]pyrimidine
CID 64876136
5-cyclopropyl-1-(3,3-dimethylbutan-2-yl)-2,5-dimethylpiperazine
CID 104830157

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole?
The IUPAC name of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole (CID 64942052) is 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole.
What is the SMILES notation for 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole?
The canonical SMILES for 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole is CCC(c1nccs1)N1CC(C)(C2CC2)NCC1C.
What is the InChIKey of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole?
The InChIKey is GIDJMWCCCKUIAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3S/c1-4-13(14-16-7-8-19-14)18-10-15(3,12-5-6-12)17-9-11(18)2/h7-8,11-13,17H,4-6,9-10H2,1-3H3.
What are the key properties of 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole?
2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole has a molecular weight of 279.45 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)propyl]-1,3-thiazole is sourced from PubChem (CID 64942052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).