2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole

C10H7N3OS — CID 141156859

IUPAC2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole
SMILESc1coc(-c2cn[nH]c2-c2nccs2)c1
InChIInChI=1S/C10H7N3OS/c1-2-8(14-4-1)7-6-12-13-9(7)10-11-3-5-15-10/h1-6H,(H,12,13)
InChIKeyLCUNJHYIGUAFQV-UHFFFAOYSA-N
MW217.25 g/mol
LogP2.79
Rot. Bonds2

About 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole

2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole (PubChem CID 141156859) has the molecular formula C10H7N3OS and a molecular weight of 217.25 g/mol. Its IUPAC name is 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole.

Molecular Properties

Compound Name2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole
PubChem CID141156859
Molecular FormulaC10H7N3OS
Molecular Weight217.25 g/mol
Exact Mass217.03
IUPAC Name2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole
SMILESc1coc(-c2cn[nH]c2-c2nccs2)c1
InChIInChI=1S/C10H7N3OS/c1-2-8(14-4-1)7-6-12-13-9(7)10-11-3-5-15-10/h1-6H,(H,12,13)
InChIKeyLCUNJHYIGUAFQV-UHFFFAOYSA-N
XLogP2.79
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.25
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-{3-[1-(1,3-thiazol-2-ylmethyl)-1H-pyrazol-3-yl]phenyl}furo[3,2-c]pyridine
CID 29182414
3-[4-(Furan-2-ylmethylsulfanyl)-1H-pyrazol-3-yl]-pyridine
CID 67284057
1-[5-(furan-2-yl)-1H-pyrazol-4-yl]-1-[4-(4-methoxyphenyl)phenyl]-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 91113437
2-[3-(furan-2-yl)-4-thiophen-2-yl-1H-pyrazol-5-yl]-1,3-thiazole
CID 141023326
2-[4-(furan-2-yl)-3-(1H-imidazol-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole
CID 141169678
2-[[5-(furan-2-yl)-1H-pyrazol-4-yl]-[4-(4-methoxyphenyl)phenyl]methyl]-1,3-thiazole
CID 142677876
2-propan-2-ylfuran;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1,3,4-thiadiazole;2-propan-2-yl-1,3-thiazole
CID 159234693
2-tert-butyl-5-[2-[2-[2-(furan-2-yl)-2-methylpropyl]-1H-pyrazol-2-ium-5-yl]-2-methylpropyl]-1,3-thiazole
CID 169817079
4-{3-[1-(1,3-thiazol-4-ylmethyl)-1H-pyrazol-3-yl]phenyl}furo[3,2-c]pyridine
CID 28312836
1-phenyl-N-{[5-(1H-pyrazol-5-yl)-2-furyl]methyl}-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 46998424
N-[[5-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]methyl]-1-(1,3-thiazol-4-yl)methanamine
CID 49464745
N-[[5-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]methyl]-2-(1,3-thiazol-2-yl)ethanamine
CID 49466023

Frequently Asked Questions

What is the IUPAC name of 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole?
The IUPAC name of 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole (CID 141156859) is 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole.
What is the SMILES notation for 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole?
The canonical SMILES for 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole is c1coc(-c2cn[nH]c2-c2nccs2)c1.
What is the InChIKey of 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole?
The InChIKey is LCUNJHYIGUAFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3OS/c1-2-8(14-4-1)7-6-12-13-9(7)10-11-3-5-15-10/h1-6H,(H,12,13).
What are the key properties of 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole?
2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole has a molecular weight of 217.25 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(furan-2-yl)-1H-pyrazol-5-yl]-1,3-thiazole is sourced from PubChem (CID 141156859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).