4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole

C11H10N2S — CID 130610117

IUPAC4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole
SMILESc1ccc2c(c1)CC(c1cscn1)N2
InChIInChI=1S/C11H10N2S/c1-2-4-9-8(3-1)5-10(13-9)11-6-14-7-12-11/h1-4,6-7,10,13H,5H2
InChIKeyLTYJWEQKKDEMTH-UHFFFAOYSA-N
MW202.28 g/mol
LogP2.85
Rot. Bonds1

About 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole

4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole (PubChem CID 130610117) has the molecular formula C11H10N2S and a molecular weight of 202.28 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole
PubChem CID130610117
Molecular FormulaC11H10N2S
Molecular Weight202.28 g/mol
Exact Mass202.06
IUPAC Name4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole
SMILESc1ccc2c(c1)CC(c1cscn1)N2
InChIInChI=1S/C11H10N2S/c1-2-4-9-8(3-1)5-10(13-9)11-6-14-7-12-11/h1-4,6-7,10,13H,5H2
InChIKeyLTYJWEQKKDEMTH-UHFFFAOYSA-N
XLogP2.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole?
The IUPAC name of 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole (CID 130610117) is 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole.
What is the SMILES notation for 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole?
The canonical SMILES for 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole is c1ccc2c(c1)CC(c1cscn1)N2.
What is the InChIKey of 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole?
The InChIKey is LTYJWEQKKDEMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2S/c1-2-4-9-8(3-1)5-10(13-9)11-6-14-7-12-11/h1-4,6-7,10,13H,5H2.
What are the key properties of 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole?
4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole has a molecular weight of 202.28 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-indol-2-yl)-1,3-thiazole is sourced from PubChem (CID 130610117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).