2-pyrazol-1-yl-1,3-thiazol-4-amine

C6H6N4S — CID 66520615

IUPAC2-pyrazol-1-yl-1,3-thiazol-4-amine
SMILESNc1csc(-n2cccn2)n1
InChIInChI=1S/C6H6N4S/c7-5-4-11-6(9-5)10-3-1-2-8-10/h1-4H,7H2
InChIKeyFDGCNKCFQXCRGA-UHFFFAOYSA-N
MW166.21 g/mol
LogP0.91
Rot. Bonds1

About 2-pyrazol-1-yl-1,3-thiazol-4-amine

2-pyrazol-1-yl-1,3-thiazol-4-amine (PubChem CID 66520615) has the molecular formula C6H6N4S and a molecular weight of 166.21 g/mol. Its IUPAC name is 2-pyrazol-1-yl-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-pyrazol-1-yl-1,3-thiazol-4-amine
PubChem CID66520615
Molecular FormulaC6H6N4S
Molecular Weight166.21 g/mol
Exact Mass166.03
IUPAC Name2-pyrazol-1-yl-1,3-thiazol-4-amine
SMILESNc1csc(-n2cccn2)n1
InChIInChI=1S/C6H6N4S/c7-5-4-11-6(9-5)10-3-1-2-8-10/h1-4H,7H2
InChIKeyFDGCNKCFQXCRGA-UHFFFAOYSA-N
XLogP0.91
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Thiazole, 2-(4-aminopyrazol-1-yl)-4-methyl-
CID 206686
2-(4-bromo-1H-pyrazol-1-yl)-1,3-thiazole
CID 56828825
1-(1,3-thiazol-2-yl)-1H-pyrazol-4-amine
CID 61175059
1-(1,3-thiazol-2-yl)-1H-pyrazol-3-amine
CID 61177157
[2-(1H-pyrazol-1-yl)-1,3-thiazol-5-yl]methanamine hydrochloride
CID 126697411
2-(1H-pyrazol-1-yl)thiazole
CID 14387157
1-[(1,3-thiazol-5-yl)methyl]-1H-pyrazol-3-amine
CID 112640510
4-(4-bromo-1H-pyrazol-1-yl)-1,3-thiazole
CID 129972947
methyl({[2-(1H-pyrazol-1-yl)-1,3-thiazol-5-yl]methyl})amine
CID 130569346
5-Methyl-2-pyrazol-1-yl-1,3-thiazole
CID 101854448
2-Pyrazol-1-yl-4-(trifluoromethyl)-1,3-thiazole
CID 122641793
1-[2-(1H-pyrazol-1-yl)-1,3-thiazol-5-yl]methanamine
CID 126697412

Frequently Asked Questions

What is the IUPAC name of 2-pyrazol-1-yl-1,3-thiazol-4-amine?
The IUPAC name of 2-pyrazol-1-yl-1,3-thiazol-4-amine (CID 66520615) is 2-pyrazol-1-yl-1,3-thiazol-4-amine.
What is the SMILES notation for 2-pyrazol-1-yl-1,3-thiazol-4-amine?
The canonical SMILES for 2-pyrazol-1-yl-1,3-thiazol-4-amine is Nc1csc(-n2cccn2)n1.
What is the InChIKey of 2-pyrazol-1-yl-1,3-thiazol-4-amine?
The InChIKey is FDGCNKCFQXCRGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4S/c7-5-4-11-6(9-5)10-3-1-2-8-10/h1-4H,7H2.
What are the key properties of 2-pyrazol-1-yl-1,3-thiazol-4-amine?
2-pyrazol-1-yl-1,3-thiazol-4-amine has a molecular weight of 166.21 g/mol, XLogP of 0.91, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazol-1-yl-1,3-thiazol-4-amine is sourced from PubChem (CID 66520615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).