5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole

C15H23N5S — CID 72875108

IUPAC5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole
SMILESCc1nn(C)c2nc(N3CCN(C4CCCC4)CC3)sc12
InChIInChI=1S/C15H23N5S/c1-11-13-14(18(2)17-11)16-15(21-13)20-9-7-19(8-10-20)12-5-3-4-6-12/h12H,3-10H2,1-2H3
InChIKeyQNOKXCXZFBCXLJ-UHFFFAOYSA-N
MW305.45 g/mol
LogP2.40
Rot. Bonds2

About 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole

5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole (PubChem CID 72875108) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole.

Molecular Properties

Compound Name5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole
PubChem CID72875108
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole
SMILESCc1nn(C)c2nc(N3CCN(C4CCCC4)CC3)sc12
InChIInChI=1S/C15H23N5S/c1-11-13-14(18(2)17-11)16-15(21-13)20-9-7-19(8-10-20)12-5-3-4-6-12/h12H,3-10H2,1-2H3
InChIKeyQNOKXCXZFBCXLJ-UHFFFAOYSA-N
XLogP2.40
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole?
The IUPAC name of 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole (CID 72875108) is 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole.
What is the SMILES notation for 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole?
The canonical SMILES for 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole is Cc1nn(C)c2nc(N3CCN(C4CCCC4)CC3)sc12.
What is the InChIKey of 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole?
The InChIKey is QNOKXCXZFBCXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-11-13-14(18(2)17-11)16-15(21-13)20-9-7-19(8-10-20)12-5-3-4-6-12/h12H,3-10H2,1-2H3.
What are the key properties of 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole?
5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole has a molecular weight of 305.45 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-cyclopentylpiperazin-1-yl)-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole is sourced from PubChem (CID 72875108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).