2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole

C11H12N2S — CID 139423358

IUPAC2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole
SMILESCC(C)c1cncc(-c2nccs2)c1
InChIInChI=1S/C11H12N2S/c1-8(2)9-5-10(7-12-6-9)11-13-3-4-14-11/h3-8H,1-2H3
InChIKeySHCTYVPAQYTARX-UHFFFAOYSA-N
MW204.30 g/mol
LogP3.33
Rot. Bonds2

About 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole

2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole (PubChem CID 139423358) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole
PubChem CID139423358
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC Name2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole
SMILESCC(C)c1cncc(-c2nccs2)c1
InChIInChI=1S/C11H12N2S/c1-8(2)9-5-10(7-12-6-9)11-13-3-4-14-11/h3-8H,1-2H3
InChIKeySHCTYVPAQYTARX-UHFFFAOYSA-N
XLogP3.33
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-propan-2-ylphenyl)-1,3-thiazole
CID 22945701
2-(5-fluoro-3-pyridinyl)-1,3-thiazole
CID 66633860
5-(5-propan-2-yl-3-pyridinyl)pyrimidin-2-amine
CID 59333399
2-[4-(1,3-thiazol-2-yl)phenyl]-1,3-thiazole
CID 901538
3-propan-2-yl-5-(1H-1,2,4-triazol-5-yl)pyridine
CID 175633387
2-(5-propan-2-ylpyrimidin-4-yl)-1,3-thiazole
CID 58415693
2-[5-methyl-6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazole
CID 130464416
2-[5-[10-[5-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;2-[5-[10-[5-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole
CID 158643567
3-(1-methylpyrazol-4-yl)-5-propan-2-ylpyridine
CID 59333396
3-(4-methoxyphenyl)-5-propan-2-ylpyridine
CID 59144720
3-(1-methylpyrazol-3-yl)-5-propan-2-ylpyridine
CID 139423359
5-[(2R)-2-[5-(1-methylpyrazol-4-yl)-3-pyridinyl]propyl]-2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole
CID 156522857

Frequently Asked Questions

What is the IUPAC name of 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole?
The IUPAC name of 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole (CID 139423358) is 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole.
What is the SMILES notation for 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole?
The canonical SMILES for 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole is CC(C)c1cncc(-c2nccs2)c1.
What is the InChIKey of 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole?
The InChIKey is SHCTYVPAQYTARX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-8(2)9-5-10(7-12-6-9)11-13-3-4-14-11/h3-8H,1-2H3.
What are the key properties of 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole?
2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole has a molecular weight of 204.30 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole is sourced from PubChem (CID 139423358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).