4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine

C13H17N5S — CID 103362422

IUPAC4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine
SMILESCc1c(N)nsc1N1CCN(c2ccccn2)CC1
InChIInChI=1S/C13H17N5S/c1-10-12(14)16-19-13(10)18-8-6-17(7-9-18)11-4-2-3-5-15-11/h2-5H,6-9H2,1H3,(H2,14,16)
InChIKeyLSPWEQOYWXJQAR-UHFFFAOYSA-N
MW275.38 g/mol
LogP1.76
Rot. Bonds2

About 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine

4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine (PubChem CID 103362422) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine.

Molecular Properties

Compound Name4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine
PubChem CID103362422
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC Name4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine
SMILESCc1c(N)nsc1N1CCN(c2ccccn2)CC1
InChIInChI=1S/C13H17N5S/c1-10-12(14)16-19-13(10)18-8-6-17(7-9-18)11-4-2-3-5-15-11/h2-5H,6-9H2,1H3,(H2,14,16)
InChIKeyLSPWEQOYWXJQAR-UHFFFAOYSA-N
XLogP1.76
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,5-dimethyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 80757583
methanamine;1-methyl-4-pyridin-2-ylpiperazine
CID 145148686
4-N,5-dimethyl-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine
CID 22329454
1-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine
CID 133313241
1-fluoro-4-pyridin-2-ylpiperazine
CID 143401045
6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 78910390
6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,5-diamine
CID 19137203
3-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)aniline
CID 115980573
1-chloro-4-pyridin-2-ylpiperazine
CID 130280526
4-pyridin-2-ylpiperazine-1-carbaldehyde;hydrochloride
CID 135186029
1-methoxy-4-pyridin-2-ylpiperazine
CID 59857720
2-(4-pyridin-2-ylpiperazin-1-yl)ethanamine;tetrahydrochloride
CID 23627586

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine?
The IUPAC name of 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine (CID 103362422) is 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine.
What is the SMILES notation for 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine?
The canonical SMILES for 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine is Cc1c(N)nsc1N1CCN(c2ccccn2)CC1.
What is the InChIKey of 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine?
The InChIKey is LSPWEQOYWXJQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-10-12(14)16-19-13(10)18-8-6-17(7-9-18)11-4-2-3-5-15-11/h2-5H,6-9H2,1H3,(H2,14,16).
What are the key properties of 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine?
4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine has a molecular weight of 275.38 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2-thiazol-3-amine is sourced from PubChem (CID 103362422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).