5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine

C8H14N4S — CID 66520381

IUPAC5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine
SMILESCN1CCN(c2cnc(N)s2)CC1
InChIInChI=1S/C8H14N4S/c1-11-2-4-12(5-3-11)7-6-10-8(9)13-7/h6H,2-5H2,1H3,(H2,9,10)
InChIKeyAESNDTSWHZDHLU-UHFFFAOYSA-N
MW198.29 g/mol
LogP0.48
Rot. Bonds1

About 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine

5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine (PubChem CID 66520381) has the molecular formula C8H14N4S and a molecular weight of 198.29 g/mol. Its IUPAC name is 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine
PubChem CID66520381
Molecular FormulaC8H14N4S
Molecular Weight198.29 g/mol
Exact Mass198.09
IUPAC Name5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine
SMILESCN1CCN(c2cnc(N)s2)CC1
InChIInChI=1S/C8H14N4S/c1-11-2-4-12(5-3-11)7-6-10-8(9)13-7/h6H,2-5H2,1H3,(H2,9,10)
InChIKeyAESNDTSWHZDHLU-UHFFFAOYSA-N
XLogP0.48
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Thiazole-2,5-diamine
CID 15208336
Guanidine, N-(2-amino-5-thiazolyl)-N'-cyano-N''-methyl-
CID 177805
2-N-ethyl-2-N-(2,2,2-trifluoroethyl)-1,3-thiazole-2,5-diamine
CID 102768077
2-N-propyl-2-N-(2,2,2-trifluoroethyl)-1,3-thiazole-2,5-diamine
CID 102768085
2-[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]-1,3-thiazol-5-amine
CID 102768376
4-Methyl-N-(2-thiazolyl)-1-piperazine thiocarboxamide
CID 5377032
1-Methyl-4-(1,3-thiazol-2-yl)piperazine
CID 10130248
1-(1-Piperazin-1-ylethyl)-3-(1,3-thiazol-2-yl)thiourea
CID 22923272
1-(2-Piperazin-1-ylethyl)-3-(1,3-thiazol-2-yl)thiourea
CID 23356571
5-Isothiocyanatothiazol-2-amine
CID 23560048
2-[4-(1,3-Thiazol-2-yl)piperazin-1-yl]ethanamine
CID 24709403
2-N-methyl-1,3-thiazole-2,5-diamine
CID 45078839

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine (CID 66520381) is 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine is CN1CCN(c2cnc(N)s2)CC1.
What is the InChIKey of 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine?
The InChIKey is AESNDTSWHZDHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-11-2-4-12(5-3-11)7-6-10-8(9)13-7/h6H,2-5H2,1H3,(H2,9,10).
What are the key properties of 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine?
5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine has a molecular weight of 198.29 g/mol, XLogP of 0.48, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 66520381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).