4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole

C15H23N5S — CID 63342299

IUPAC4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole
SMILESCCC(c1nc(-c2cnn(CC)c2)cs1)N1CCNCC1
InChIInChI=1S/C15H23N5S/c1-3-14(19-7-5-16-6-8-19)15-18-13(11-21-15)12-9-17-20(4-2)10-12/h9-11,14,16H,3-8H2,1-2H3
InChIKeyNYNGCXDOUYFNQW-UHFFFAOYSA-N
MW305.45 g/mol
LogP2.38
Rot. Bonds5

About 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole

4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole (PubChem CID 63342299) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole
PubChem CID63342299
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole
SMILESCCC(c1nc(-c2cnn(CC)c2)cs1)N1CCNCC1
InChIInChI=1S/C15H23N5S/c1-3-14(19-7-5-16-6-8-19)15-18-13(11-21-15)12-9-17-20(4-2)10-12/h9-11,14,16H,3-8H2,1-2H3
InChIKeyNYNGCXDOUYFNQW-UHFFFAOYSA-N
XLogP2.38
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-phenyl-2-(1-piperazin-1-ylpropyl)-1,3-thiazole
CID 63342212
2,5-dimethyl-4-[2-(1-piperazin-1-ylpropyl)-1,3-thiazol-4-yl]-1,3-thiazole
CID 63752075
4-(4-bromothiophen-2-yl)-2-(1-piperazin-1-ylbutyl)-1,3-thiazole
CID 107354715
ethyl 2-[2-(1-piperazin-1-ylpropyl)-1,3-thiazol-4-yl]acetate
CID 107380194
2-(1-piperazin-1-ylbutyl)-4-propyl-1,3-thiazole
CID 55203528
4-(1-ethylpyrazol-4-yl)-2-(1H-1,2,4-triazol-5-yl)-1,3-thiazole
CID 62944792
2-[1-(1,4-diazepan-1-yl)propyl]-1,3-thiazole
CID 64948646
2-(1-piperazin-1-ylbutyl)-4-(trifluoromethyl)-1,3-thiazole
CID 63342689
1-[(1R)-1-(4-bromothiophen-2-yl)propyl]piperazine
CID 95490471
[4-(1-ethylpyrazol-4-yl)-1,3-thiazol-2-yl]-phenylmethanone
CID 63346809
6-(1-ethylpyrazol-4-yl)-2-propylpyridine-3-carboxylic acid
CID 116533312
4-(3-fluorophenyl)-2-(1-piperazin-1-ylethyl)-1,3-thiazole
CID 63342291

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole?
The IUPAC name of 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole (CID 63342299) is 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole.
What is the SMILES notation for 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole?
The canonical SMILES for 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole is CCC(c1nc(-c2cnn(CC)c2)cs1)N1CCNCC1.
What is the InChIKey of 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole?
The InChIKey is NYNGCXDOUYFNQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-3-14(19-7-5-16-6-8-19)15-18-13(11-21-15)12-9-17-20(4-2)10-12/h9-11,14,16H,3-8H2,1-2H3.
What are the key properties of 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole?
4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole has a molecular weight of 305.45 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethylpyrazol-4-yl)-2-(1-piperazin-1-ylpropyl)-1,3-thiazole is sourced from PubChem (CID 63342299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).