2-(1-methylindol-3-yl)-1,3-thiazole

C12H10N2S — CID 11275932

IUPAC2-(1-methylindol-3-yl)-1,3-thiazole
SMILESCn1cc(-c2nccs2)c2ccccc21
InChIInChI=1S/C12H10N2S/c1-14-8-10(12-13-6-7-15-12)9-4-2-3-5-11(9)14/h2-8H,1H3
InChIKeyUZRNJZSSOYHALG-UHFFFAOYSA-N
MW214.29 g/mol
LogP3.30
Rot. Bonds1

About 2-(1-methylindol-3-yl)-1,3-thiazole

2-(1-methylindol-3-yl)-1,3-thiazole (PubChem CID 11275932) has the molecular formula C12H10N2S and a molecular weight of 214.29 g/mol. Its IUPAC name is 2-(1-methylindol-3-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(1-methylindol-3-yl)-1,3-thiazole
PubChem CID11275932
Molecular FormulaC12H10N2S
Molecular Weight214.29 g/mol
Exact Mass214.06
IUPAC Name2-(1-methylindol-3-yl)-1,3-thiazole
SMILESCn1cc(-c2nccs2)c2ccccc21
InChIInChI=1S/C12H10N2S/c1-14-8-10(12-13-6-7-15-12)9-4-2-3-5-11(9)14/h2-8H,1H3
InChIKeyUZRNJZSSOYHALG-UHFFFAOYSA-N
XLogP3.30
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-3-yl)-1,3-thiazole?
The IUPAC name of 2-(1-methylindol-3-yl)-1,3-thiazole (CID 11275932) is 2-(1-methylindol-3-yl)-1,3-thiazole.
What is the SMILES notation for 2-(1-methylindol-3-yl)-1,3-thiazole?
The canonical SMILES for 2-(1-methylindol-3-yl)-1,3-thiazole is Cn1cc(-c2nccs2)c2ccccc21.
What is the InChIKey of 2-(1-methylindol-3-yl)-1,3-thiazole?
The InChIKey is UZRNJZSSOYHALG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2S/c1-14-8-10(12-13-6-7-15-12)9-4-2-3-5-11(9)14/h2-8H,1H3.
What are the key properties of 2-(1-methylindol-3-yl)-1,3-thiazole?
2-(1-methylindol-3-yl)-1,3-thiazole has a molecular weight of 214.29 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-3-yl)-1,3-thiazole is sourced from PubChem (CID 11275932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).