4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole

C11H8N4S — CID 141340133

IUPAC4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole
SMILESc1cncc(-c2nc(-c3ccn[nH]3)cs2)c1
InChIInChI=1S/C11H8N4S/c1-2-8(6-12-4-1)11-14-10(7-16-11)9-3-5-13-15-9/h1-7H,(H,13,15)
InChIKeyJQEBNJAZDBOEIP-UHFFFAOYSA-N
MW228.28 g/mol
LogP2.60
Rot. Bonds2

About 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole

4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole (PubChem CID 141340133) has the molecular formula C11H8N4S and a molecular weight of 228.28 g/mol. Its IUPAC name is 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole
PubChem CID141340133
Molecular FormulaC11H8N4S
Molecular Weight228.28 g/mol
Exact Mass228.05
IUPAC Name4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole
SMILESc1cncc(-c2nc(-c3ccn[nH]3)cs2)c1
InChIInChI=1S/C11H8N4S/c1-2-8(6-12-4-1)11-14-10(7-16-11)9-3-5-13-15-9/h1-7H,(H,13,15)
InChIKeyJQEBNJAZDBOEIP-UHFFFAOYSA-N
XLogP2.60
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole
CID 119088487
4-(4-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole
CID 592589
4-methyl-5-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole
CID 58416122
4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole
CID 849786
4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole
CID 2800024
[3-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]methanamine
CID 63152435
2-(2-pyridin-3-yl-1,3-thiazol-4-yl)benzamide
CID 139933693
N-methyl-4-(4-pyridin-3-yl-1,3-thiazol-2-yl)aniline
CID 116965446
4-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)-2-pyridin-3-yl-1,3-thiazole
CID 84715807
bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone
CID 175265157
(2-pyridin-3-yl-1,3-thiazol-4-yl)methanediol
CID 130242448
5-(2-pyridin-3-yl-1,3-thiazol-4-yl)furan-3-carboxylic acid
CID 63355636

Frequently Asked Questions

What is the IUPAC name of 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole?
The IUPAC name of 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole (CID 141340133) is 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole.
What is the SMILES notation for 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole?
The canonical SMILES for 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole is c1cncc(-c2nc(-c3ccn[nH]3)cs2)c1.
What is the InChIKey of 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole?
The InChIKey is JQEBNJAZDBOEIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4S/c1-2-8(6-12-4-1)11-14-10(7-16-11)9-3-5-13-15-9/h1-7H,(H,13,15).
What are the key properties of 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole?
4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole has a molecular weight of 228.28 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 141340133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).