2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole

C10H17N3S — CID 82065439

IUPAC2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole
SMILESCc1nc(CCN2CCNCC2)cs1
InChIInChI=1S/C10H17N3S/c1-9-12-10(8-14-9)2-5-13-6-3-11-4-7-13/h8,11H,2-7H2,1H3
InChIKeyIQJYTEQDEWEUSF-UHFFFAOYSA-N
MW211.33 g/mol
LogP0.90
Rot. Bonds3

About 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole

2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole (PubChem CID 82065439) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole
PubChem CID82065439
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole
SMILESCc1nc(CCN2CCNCC2)cs1
InChIInChI=1S/C10H17N3S/c1-9-12-10(8-14-9)2-5-13-6-3-11-4-7-13/h8,11H,2-7H2,1H3
InChIKeyIQJYTEQDEWEUSF-UHFFFAOYSA-N
XLogP0.90
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-4-(piperazin-1-ylmethyl)-1,3-thiazole;dihydrochloride
CID 46735539
N-[2-(1,4-diazepan-1-yl)ethyl]-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 106052580
4-(2-piperazin-1-ylethyl)-1,3-thiazol-2-amine
CID 82508561
4-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]piperazine-2,6-dione
CID 106045753
2-cyclopropyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole
CID 96900907
2-methyl-4-[2-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]ethyl]-1,3-thiazole
CID 129059210
2-(2-methoxyethyl)-4-(2-piperazin-1-ylethyl)-1,3-thiazole
CID 82065442
2-(2,6-difluorophenyl)-4-(2-piperazin-1-ylethyl)-1,3-thiazole
CID 93213722
4-[2-(1,4-diazaspiro[5.5]undecan-4-yl)ethyl]-2-methyl-1,3-thiazole
CID 106043482
2-methyl-4-[2-[3-(2-methylpropyl)piperazin-1-yl]ethyl]-1,3-thiazole
CID 106043488
[1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrrolidin-3-yl]methanol
CID 103880843
4-[2-(6,10-diazaspiro[4.6]undecan-10-yl)ethyl]-2-methyl-1,3-thiazole
CID 106043606

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole?
The IUPAC name of 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole (CID 82065439) is 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole.
What is the SMILES notation for 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole?
The canonical SMILES for 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole is Cc1nc(CCN2CCNCC2)cs1.
What is the InChIKey of 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole?
The InChIKey is IQJYTEQDEWEUSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-9-12-10(8-14-9)2-5-13-6-3-11-4-7-13/h8,11H,2-7H2,1H3.
What are the key properties of 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole?
2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole has a molecular weight of 211.33 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(2-piperazin-1-ylethyl)-1,3-thiazole is sourced from PubChem (CID 82065439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).